Structure Information
Structure

Compound Identification

SMILES

NC(=O)C1CC(CCO1)[N+]1(CCN2C(C1)=C(C(O)=O)C(Cl)=C2C1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=PEFPNTMGGLGUPB-UHFFFAOYSA-O

Formula

C21H23ClN3O6

Mass

448.88

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylpyrrole - Pyrrole-3-carboxylic acid - 1-carboxy-2-haloaromatic compound - Pyrrole-3-carboxylic acid or derivatives - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Oxane - Pyran - Benzenoid - Heteroaromatic compound - Vinylogous amide - Vinylogous halide - Quaternary ammonium salt - Carbamic acid derivative - Carboxamide group - Primary carboxylic acid amide - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic cation - 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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