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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nitro compound > c-nitro compound > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > ester > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > ester > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > ester > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > alpha,beta-unsaturated carboxylic ester > enoate ester > 2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate

Preferred term

2,4-dinitro-6-(octan-2-yl)phenyl (e)-but-2-enoate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

Narrower concepts

charge

  • 0

formula

  • C18H24N2O6

inchi

  • InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+

inchikey

  • NIOPZPCMRQGZCE-WEVVVXLNSA-N

mass

  • 364.39300

monoisotopicmass

  • 364.16344

smiles

  • CCCCCCC(C)c1cc(cc(c1OC(=O)/C=C/C)[N+]([O-])=O)[N+]([O-])=O

subset

  • 3_STAR

synonym EXACT

  • 2,4-dinitro-6-(octan-2-yl)phenyl (2E)-but-2-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:83375

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