Structure Information
Structure

Compound Identification

SMILES

COC1=C(OCC(C)(C)O)C=CC(=C1)N1C=NN2C=C(C=C2C1=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=GDEZUWDWHVVOHV-UHFFFAOYSA-N

Formula

C23H22ClN3O4

Mass

439.9

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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

Pyrrolo[2,1-f][1,2,4]triazines Methoxyanilines Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Chlorobenzenes 1,2,4-triazines Aryl chlorides Tertiary alcohols Heteroaromatic compounds Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-phenylpyrrole - Methoxyaniline - Pyrrolo[2,1-f][1,2,4]triazine - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,2,4-triazine - Triazine - Benzenoid - Heteroaromatic compound - Tertiary alcohol - Lactam - Ether - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Alcohol - Aromatic heteropolycyclic 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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