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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > 2-hydroxy-3-methylbenzoic acid (3-cyano-4-imino-2-oxopentyl) ester
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > 2-hydroxy-3-methylbenzoic acid (3-cyano-4-imino-2-oxopentyl) ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > 2-hydroxy-3-methylbenzoic acid (3-cyano-4-imino-2-oxopentyl) ester
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > 2-hydroxy-3-methylbenzoic acid (3-cyano-4-imino-2-oxopentyl) ester
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > 2-hydroxy-3-methylbenzoic acid (3-cyano-4-imino-2-oxopentyl) ester
organic aromatic compound > phenols > 2-hydroxy-3-methylbenzoic acid (3-cyano-4-imino-2-oxopentyl) ester

Preferred term

2-hydroxy-3-methylbenzoic acid (3-cyano-4-imino-2-oxopentyl) ester  

Type

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

Broader concept

charge

  • 0

formula

  • C14H14N2O4

has_functional_parent

inchi

  • InChI=1S/C14H14N2O4/c1-8-4-3-5-10(13(8)18)14(19)20-7-12(17)11(6-15)9(2)16/h3-5,11,16,18H,7H2,1-2H3

inchikey

  • UKUMTRNTAMVXJX-UHFFFAOYSA-N

mass

  • 274.272

monoisotopicmass

  • 274.09536

smiles

  • CC1=CC=CC(=C1O)C(=O)OCC(=O)C(C#N)C(=N)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:112747

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