Structure Information
Structure

Compound Identification

SMILES

OC(C(N=[N+]=[N-])C1=CC=C(C=C1)[N+]([O-])=O)C(O)=O

InChIKey

InChIKey=LOOVGUNKHCQWMI-UHFFFAOYSA-N

Formula

C9H8N4O5

Mass

252.186

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

3-phenylpropanoic-acid - Nitrobenzene - Nitroaromatic compound - Alpha-hydroxy acid - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Azo compound - Azo imide - Organic nitro compound - C-nitro compound - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic nitrogen compound - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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