Compound Identification
SMILES
CC(=O)OC1=CC=C(C=C1)C1NC(CC2=CNC3=CC=CC=C23)(C2C1C(=O)N(C2=O)C1=CC(Cl)=C(C)C=C1)C(O)=O
InChIKey
InChIKey=NEOYNIKHHYVHKB-UHFFFAOYSA-N
Formula
C31H26ClN3O6
Mass
572.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Phenol esters 3-alkylindoles Alpha amino acids Pyrrolidine carboxylic acids Phenoxy compounds Toluenes Chlorobenzenes Aralkylamines Substituted pyrroles Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides Dicarboxylic acids and derivatives Heteroaromatic compounds Dicarboximides Amino acids Carboxylic acid esters Lactams Carboxylic acids Azacyclic compounds Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 2-phenylpyrrolidine - Alpha-amino acid - Phenol ester - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Phenoxy compound - Aralkylamine - Chlorobenzene - Toluene - Halobenzene - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - Dicarboxylic acid or derivatives - Aryl chloride - Aryl halide - Heteroaromatic compound - Pyrrole - Dicarboximide - Carboxylic acid imide - Carboxylic acid ester - Amino acid - Amino acid or derivatives - Lactam - Azacycle - Carboxylic acid derivative - Secondary amine - Carboxylic acid - Secondary aliphatic amine - Organooxygen compound - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available