Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(O)=O.COC(=O)C1=CC(=C(OCCCN2CCN(CC2)C2=CC(=O)N(C)C(=O)N2C)C=C1)[N+]([O-])=O

InChIKey

InChIKey=OPAILPKFEPMUFH-UHFFFAOYSA-N

Formula

C23H29N5O11

Mass

551.509

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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

Not available

Substituents

Nitrobenzoate - N-arylpiperazine - Nitrophenyl ether - Benzoate ester - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - Dialkylarylamine - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - N-alkylpiperazine - 1,4-diazinane - Dicarboxylic acid or derivatives - Hydropyrimidine - Piperazine - Pyrimidine - Methyl ester - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Amino acid or derivatives - Lactam - C-nitro compound - Urea - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Carbonyl group - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Organooxygen compound - Organic salt - Organonitrogen compound - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic 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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