Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C(OC)=C(C=C1)N1CC2=C(C1)C=C(NC1=C(C=CC(=C1)[N+]([O-])=O)C(O)=O)C=C2

InChIKey

InChIKey=XJTCINOJCCBROK-UHFFFAOYSA-N

Formula

C24H23N3O7

Mass

465.462

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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 heteropolycyclic compounds

Substituents

Nitrobenzoate - Aminobenzoic acid - Aminobenzoic acid or derivatives - Benzoic acid - Isoindoline - Isoindole - Isoindole or derivatives - Nitrobenzene - Aminophenyl ether - Methoxyaniline - Methoxybenzene - Nitroaromatic compound - Aniline or substituted anilines - Dialkylarylamine - Anisole - Phenol ether - Phenoxy compound - Tertiary aliphatic/aromatic amine - Benzoyl - Aralkylamine - Alkyl aryl ether - Primary aromatic amine - Vinylogous amide - C-nitro compound - Tertiary amine - Organic nitro compound - Amino acid or derivatives - Amino acid - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic oxygen compound - Organic salt - Amine - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic 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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