Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C1NC(CC2=CC=CC=C2)(C2C1C(=O)N(C2=O)C1=CC(Cl)=C(C)C=C1)C(O)=O
InChIKey
InChIKey=SSGSYVVZEWSVLK-UHFFFAOYSA-N
Formula
C29H25ClN2O6
Mass
532.98
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
Phenylpropanoic acids Alpha amino acids Amphetamines and derivatives Benzoic acid esters Pyrrolidine carboxylic acids Benzoyl derivatives Toluenes Aralkylamines Chlorobenzenes Pyrrolidine-2-ones N-substituted carboxylic acid imides Aryl chlorides Pyrroles Methyl esters Dicarboximides Lactams Amino acids Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Carbonyl compounds Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpropanoic-acid - 1-phenylpyrrolidine - 2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Aralkylamine - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - Pyrrole - Methyl ester - Dicarboximide - Carboxylic acid imide - Lactam - Amino acid or derivatives - Carboxylic acid ester - Amino acid - Secondary amine - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen 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