Compound Identification
SMILES
COC1=C(Cl)C=C(C=C1)C(O)=C1C(N(CC2=CN=CC=C2)C(=O)C1=O)C1=CC=C(C=C1)C(C)(C)C
InChIKey
InChIKey=AQWQDUZQICOBAW-UHFFFAOYSA-N
Formula
C28H27ClN2O4
Mass
490.98
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
Phenylpropanes Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Aryl chlorides Pyrrolidine-3-ones Pyrrolidine-2-ones N-alkylpyrrolidines Pyridines and derivatives Vinylogous acids Heteroaromatic compounds Pyrroles Tertiary carboxylic acid amides Lactams Cyclic ketones Azacyclic compounds Enols Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenylpropane - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Vinylogous acid - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Cyclic ketone - Carboxamide group - Lactam - Ketone - Azacycle - Carboxylic acid derivative - Ether - Enol - Organooxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic 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