Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(NC2=C(C=CC(Cl)=C2C(O)=O)[N+]([O-])=O)C=C1

InChIKey

InChIKey=ZBHFGCUGJKEJPY-UHFFFAOYSA-N

Formula

C15H13ClN2O6

Mass

352.73

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Nitrobenzoate - Aminobenzoic acid - Halobenzoic acid - 2-halobenzoic acid - Aminobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - O-dimethoxybenzene - Dimethoxybenzene - Aminophenyl ether - Benzoic acid - Nitrobenzene - Methoxyaniline - Aniline or substituted anilines - Methoxybenzene - Phenol ether - 1-carboxy-2-haloaromatic compound - Benzoyl - Anisole - Nitroaromatic compound - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Primary aromatic amine - Vinylogous halide - Vinylogous amide - Amino acid - Amino acid or derivatives - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxoazanium - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organic oxide - Amine - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzoic acids and derivatives. These are compounds containing a nitrobenzoic acid moiety, which consists of a benzene ring bearing both a carboxylic acid group and a nitro group on two different ring carbon atoms.

External Descriptors

Not available

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