Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)N1CCC2(C1)CCN(CC2)C(=O)C1=C(C)ON=C1C)[N+]([O-])=O

InChIKey

InChIKey=PBLISIFMPALIRY-UHFFFAOYSA-N

Formula

C23H26N4O7

Mass

470.482

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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 - Azaspirodecane - Benzoate ester - Benzamide - N-acyl-piperidine - Nitrobenzene - Nitroaromatic compound - Benzoyl - N-acylpyrrolidine - Piperidine - Azole - Isoxazole - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Methyl ester - Carboxamide group - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Oxacycle - Carboxylic acid derivative - Organic salt - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organic cation - 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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