Structure Information
Structure

Compound Identification

SMILES

COC1=C(NC(=O)C(=CC2=CC=CC=C2OS(=O)(=O)C2=CC=C(NC(C)=O)C=C2)C#N)C=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=MWHYXBLAHVXLJU-UHFFFAOYSA-N

Formula

C25H20N4O8S

Mass

536.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Hydroxycinnamic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Coumaric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Coumaric acid or derivatives - Cinnamic acid amide - Nitrophenyl ether - Benzenesulfonate ester - Benzenesulfonate - Acetanilide - Nitrobenzene - Anilide - Methoxyaniline - Benzenesulfonyl group - N-acetylarylamine - Arylsulfonic acid or derivatives - Methoxybenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - N-arylamide - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid ester - Acetamide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Secondary carboxylic acid amide - Carboxamide group - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Ether - Nitrile - Carbonitrile - Organic zwitterion - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Cyanide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.

External Descriptors

Not available

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