Compound Identification
SMILES
ClC1=CC=C(C=C1)N1C(=O)C=C(N2CC[NH+](CC3=CC=CC=C3)CC2)C1=O
InChIKey
InChIKey=VFDDXZADSBOYKX-UHFFFAOYSA-O
Formula
C21H21ClN3O2
Mass
382.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
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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 Phenylmethylamines Benzylamines Aralkylamines N-alkylpiperazines Maleimides Chlorobenzenes Aryl chlorides N-substituted carboxylic acid imides Vinylogous amides Quaternary ammonium salts Pyrroles Dicarboximides Trialkylamines Azacyclic compounds Enamines Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrroline - Alpha-amino acid or derivatives - Phenylmethylamine - Benzylamine - Halobenzene - Chlorobenzene - Maleimide - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Aryl chloride - Aryl halide - Benzenoid - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Dicarboximide - Quaternary ammonium salt - Pyrrole - Carboxylic acid imide - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Enamine - Organonitrogen compound - Organooxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic 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