Compound Identification
SMILES
CC1=CC(C=C(C#N)C(=O)OCC(=O)C2=CNC3=CC=CC=C23)=C(C)N1C1=CC(=C(Cl)C=C1)C(F)(F)F
InChIKey
InChIKey=TYGFDUSORBOPRG-UHFFFAOYSA-N
Formula
C27H19ClF3N3O3
Mass
525.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Trifluoromethylbenzenes Indoles Aryl alkyl ketones Alpha-acyloxy ketones Fatty acid esters Chlorobenzenes Aryl chlorides Vinylogous amides Heteroaromatic compounds Enoate esters Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Trifluoromethylbenzene - Indole - Indole or derivatives - Aryl alkyl ketone - Aryl ketone - Chlorobenzene - Fatty acid ester - Halobenzene - Alpha-acyloxy ketone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Azacycle - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Organic nitrogen compound - Alkyl halide - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organochloride - Organofluoride - Carbonyl group - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen 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