Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=CNC1=NC=NC2=C1C(=CN2C1=CC(Cl)=C(F)C=C1)C1=CC=CC=C1)C(=O)OCC

InChIKey

InChIKey=UBKLJWJZFXABMX-UHFFFAOYSA-N

Formula

C26H22ClFN4O4

Mass

508.93

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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[2,3-d]pyrimidines Aminopyrimidines and derivatives Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Imidolactams Dicarboxylic acids and derivatives Vinylogous amides Heteroaromatic compounds Enoate esters Azacyclic compounds Enamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-phenylpyrrole - 1-phenylpyrrole - Pyrrolo[2,3-d]pyrimidine - Pyrrolopyrimidine - Aminopyrimidine - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl chloride - Aryl fluoride - Dicarboxylic acid or derivatives - Aryl halide - Imidolactam - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Enamine - Carboxylic acid derivative - Azacycle - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - 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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