Compound Identification
SMILES
CCOCCN1C(NC2CCN(CCC3(CCN(C3)C(=O)C3=C(OC)C=CC(=C3)N3C=NN=C3)C3=CC=CC=C3)CC2)=NC2=CC=CC=C12
InChIKey
InChIKey=VTVRAICQYMCQKY-UHFFFAOYSA-N
Formula
C38H46N8O3
Mass
662.839
Taxonomic Classification
Taxonomy Tree
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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
Phenyl-1,2,4-triazoles Benzamides Benzimidazoles Methoxyanilines Anisoles Phenoxy compounds Benzoyl derivatives N-acylpyrrolidines Methoxybenzenes Alkyl aryl ethers Aralkylamines Piperidines Aminoimidazoles N-substituted imidazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Trialkylamines Amino acids and derivatives Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrolidine - Phenyltriazole - Phenyl-1,2,4-triazole - Benzamide - Benzimidazole - Benzoic acid or derivatives - Methoxyaniline - Methoxybenzene - N-acylpyrrolidine - Phenoxy compound - Benzoyl - Anisole - Phenol ether - Aralkylamine - Alkyl aryl ether - Aminoimidazole - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Piperidine - Pyrrole - Azole - Tertiary carboxylic acid amide - Triazole - 1,2,4-triazole - Heteroaromatic compound - Imidazole - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organonitrogen compound - Organic oxygen compound - Amine - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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