Structure Information
Structure

Compound Identification

SMILES

CC(C)OC(=O)C1=CC=CC(=C1)C1=NC2=CC(=C(Cl)C=C2N1)[N+]([O-])=O

InChIKey

InChIKey=PNMRLVQFUJJBNT-UHFFFAOYSA-N

Formula

C17H14ClN3O4

Mass

359.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

Phenylbenzimidazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbenzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylbenzimidazole - 2-phenylimidazole - Benzoate ester - Benzoic acid or derivatives - Nitroaromatic compound - Benzoyl - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Imidazole - Azole - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylbenzimidazoles. These are compounds containing a phenylbenzimidazole skeleton, which consists of a benzimidazole moiety where its imidazole ring is attached to a phenyl group.

External Descriptors

Not available

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