Compound Identification
SMILES
CC(N)=C(C#N)C(=O)COC(=O)C1=CC=C(C=C1)N1C(C)=CC=C1C
InChIKey
InChIKey=ITBZBURAUQTZLM-UHFFFAOYSA-N
Formula
C19H19N3O3
Mass
337.379
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
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Benzoic acid esters Benzoyl derivatives Alpha-branched alpha,beta-unsaturated ketones Acryloyl compounds Vinylogous amides Enones Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Ketones Enamines Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Acryloyl-group - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated ketone - Enone - Amino acid or derivatives - Carboxylic acid ester - Ketone - Azacycle - Carboxylic acid derivative - Enamine - Carbonitrile - Nitrile - Organic oxygen compound - Primary amine - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Cyanide - 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