Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(C=C1)[N+]([O-])=O)N1C(C)=CC(C=C(C#N)C2=CC=CC=C2Cl)=C1C

InChIKey

InChIKey=KNDLOFMTFQRJRR-UHFFFAOYSA-N

Formula

C22H18ClN3O3

Mass

407.85

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroles

Subclass

Substituted pyrroles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrroles

Alternative Parents

Nitrophenyl ethers Methoxyanilines Styrenes Phenoxy compounds Anisoles Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Nitriles Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Organic cations

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrophenyl ether - 1-phenylpyrrole - Nitrobenzene - Methoxyaniline - Styrene - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Azacycle - Ether - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic oxide - Cyanide - Organic salt - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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