Compound Identification
SMILES
COC1=C(OCCN2C3=CC=CC=C3N=C2[C@@H]2CN(C(=O)C2)C2=CC=CC=C2C)C=CC(CC=C)=C1
InChIKey
InChIKey=WAPDJCIVGBLXNW-QHCPKHFHSA-N
Formula
C30H31N3O3
Mass
481.596
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
Benzimidazoles Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Toluenes N-substituted imidazoles Pyrrolidine-2-ones Pyrroles Heteroaromatic compounds Tertiary carboxylic acid amides Amino acids and derivatives Lactams Tertiary amines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Benzimidazole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - N-substituted imidazole - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Azole - Imidazole - Amino acid or derivatives - Tertiary amine - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Ether - Carbonyl group - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Amine - 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