Compound Identification
SMILES
COC1=CC=C(C=C1)C(O)=C1C(N(C2=NC(C)=C(S2)C(C)=O)C(=O)C1=O)C1=CC=C(OCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=IRACWANMHRUNKI-UHFFFAOYSA-N
Formula
C31H26N2O6S
Mass
554.62
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
Phenoxy compounds 2,4,5-trisubstituted thiazoles Methoxybenzenes Anisoles Aryl alkyl ketones Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Lactams Cyclic ketones Azacyclic compounds Enols Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Pyrrolidone - Benzenoid - 2-pyrrolidone - 3-pyrrolidone - Azole - Heteroaromatic compound - Pyrrole - Vinylogous acid - Thiazole - Tertiary carboxylic acid amide - Lactam - Ketone - Carboxamide group - Cyclic ketone - Ether - Enol - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - 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