Compound Identification
SMILES
CC1=C\C(=C2\NNC3=C2C(N(CCO)C3=O)C2=CC(Cl)=C(Cl)C=C2)C(=O)C(C)=C1
InChIKey
InChIKey=YCKJVMDMFQEFKJ-LGMDPLHJSA-N
Formula
C21H19Cl2N3O3
Mass
432.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Alpha amino acids and derivatives Dichlorobenzenes O-quinomethanes Aryl chlorides Pyrazolines Vinylogous amides Pyrroles Tertiary carboxylic acid amides Lactams Alkanolamines Azacyclic compounds Primary alcohols Organochlorides Organic oxides Hydrocarbon derivatives Hydrazines and derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Alpha-amino acid or derivatives - 1,2-dichlorobenzene - Quinomethane - O-quinomethane - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Tertiary carboxylic acid amide - Pyrrole - Pyrazoline - Carboxamide group - Cyclic ketone - Ketone - Lactam - Alkanolamine - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Hydrazine derivative - Primary alcohol - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.
External Descriptors
Not available