Compound Identification
SMILES
COC1=CC(C=CC2C3=CCC4C(C3CC3C(=O)N(C(=O)C23C)C2=CC(=NN2C)C2=C(C)C3=C(S2)C=CC(Cl)=C3)C(=O)N(C4=O)C2=CC=C(C=C2)C2=NC3=CC=CC=C3O2)=CC(OC)=C1O
InChIKey
InChIKey=DOEVMIUGKYUDQQ-UHFFFAOYSA-N
Formula
C51H42ClN5O8S
Mass
920.43
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-1,3-oxazoles Dimethoxybenzenes Isoindolones Methoxyphenols 1-benzothiophenes Benzoxazoles Anisoles Styrenes Phenoxy compounds Alkyl aryl ethers Aryl chlorides N-substituted carboxylic acid imides Pyrrolidine-2-ones Thiophenes Pyrazoles Pyrroles Dicarboximides Heteroaromatic compounds Lactams Azacyclic compounds Oxacyclic compounds Carbonyl compounds Organochlorides Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Phenyl-1,3-oxazole - Methoxyphenol - Isoindolone - Dimethoxybenzene - M-dimethoxybenzene - Isoindole or derivatives - Isoindoline - 1-benzothiophene - Benzoxazole - Benzothiophene - Phenol ether - Styrene - Anisole - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Phenol - Aryl chloride - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Aryl halide - Azole - Heteroaromatic compound - Carboxylic acid imide - Dicarboximide - Thiophene - Pyrrole - Pyrazole - Oxazole - Lactam - Ether - Carboxylic acid derivative - Azacycle - Oxacycle - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen 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