Structure Information
Structure

Compound Identification

SMILES

CN(C)C(=N/OC(=O)C1=CC=C(C=C1)[N+]([O-])=O)\C1=NON=C1N

InChIKey

InChIKey=NRPGDUOHSFSSCM-WJDWOHSUSA-N

Formula

C12H12N6O5

Mass

320.265

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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 heteromonocyclic compounds

Substituents

Nitrobenzoate - Nitrobenzene - Nitroaromatic compound - Benzoyl - Imidolactam - Azole - Furazan - Heteroaromatic compound - Oxadiazole - Amino acid or derivatives - C-nitro compound - Organic nitro compound - Amidine - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic salt - Primary amine - Organic zwitterion - Amine - Hydrocarbon derivative - Organic nitrogen compound - 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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