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Chemistry, part 2

Content language

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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-sec-butyl-4,6-dinitrophenyl 3-methylbut-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-sec-butyl-4,6-dinitrophenyl 3-methylbut-2-enoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > 2-sec-butyl-4,6-dinitrophenyl 3-methylbut-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-sec-butyl-4,6-dinitrophenyl 3-methylbut-2-enoate

Preferred term

2-sec-butyl-4,6-dinitrophenyl 3-methylbut-2-enoate  

Type

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

Broader concept

Narrower concepts

charge

  • 0

formula

  • C15H18N2O6

has_functional_parent

inchi

  • InChI=1S/C15H18N2O6/c1-5-10(4)12-7-11(16(19)20)8-13(17(21)22)15(12)23-14(18)6-9(2)3/h6-8,10H,5H2,1-4H3

inchikey

  • ZRDUSMYWDRPZRM-UHFFFAOYSA-N

mass

  • 322.31320

monoisotopicmass

  • 322.11649

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 2-(butan-2-yl)-4,6-dinitrophenyl 3-methylbut-2-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:83366

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