Compound Identification
SMILES
CC1=CC(=CC(C)=C1O)C1NC(CC2=CC=CC=C2)(C2C1C(=O)N(CC1=CC=CC=C1)C2=O)C(O)=O
InChIKey
InChIKey=BJLKVJDXTATSEE-UHFFFAOYSA-N
Formula
C29H28N2O5
Mass
484.552
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Phenylpropanoic acids Alpha amino acids Amphetamines and derivatives m-Xylenes Pyrrolidine carboxylic acids Ortho cresols Aralkylamines Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Pyrroles Dicarboximides Amino acids Lactams Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpropanoic-acid - 2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - M-xylene - Xylene - O-cresol - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Phenol - Aralkylamine - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - N-alkylpyrrolidine - Pyrrolidone - 2-pyrrolidone - Pyrrole - Dicarboximide - Carboxylic acid imide - Amino acid - Amino acid or derivatives - Lactam - Azacycle - Secondary amine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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