Structure Information
Structure

Compound Identification

SMILES

COC1=C(C(NC(C)=O)=C(Cl)C=C1C1=NC(=C(C)N1)C1=CN=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=KHLFVLXLDZEOGW-UHFFFAOYSA-N

Formula

C18H16ClN5O4

Mass

401.81

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Phenylimidazoles

Alternative Parents

Nitrophenyl ethers O-haloacetanilides Methoxyanilines N-acetylarylamines 2,4,5-trisubstituted imidazoles Anisoles Nitroaromatic compounds Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Pyridines and derivatives Aryl chlorides Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylimidazole - O-haloacetanilide - Haloacetanilide - Nitrophenyl ether - Acetanilide - Nitrobenzene - Anilide - Methoxyaniline - N-acetylarylamine - Nitroaromatic compound - N-arylamide - Phenoxy compound - Phenol ether - 2,4,5-trisubstituted-imidazole - Trisubstituted imidazole - Methoxybenzene - Anisole - Chlorobenzene - Alkyl aryl ether - Halobenzene - Monocyclic benzene moiety - Benzenoid - Pyridine - Aryl halide - Aryl chloride - Acetamide - Heteroaromatic compound - Organic nitro compound - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.

External Descriptors

Not available

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