Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=C(C=C1)N1C[C@@]23O[C@H](C=C2)[C@@H]([C@@H]3C1=O)C([O-])=O

InChIKey

InChIKey=BNIHANGYWGPWGD-OEUWWYETSA-M

Formula

C17H16NO4

Mass

298.319

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolidines

Subclass

Phenylpyrrolidines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolidines

Alternative Parents

Isoindolones Furopyrroles Pyrrolidine-2-ones Benzene and substituted derivatives Tertiary carboxylic acid amides Pyrroles Oxolanes Dihydrofurans Furans Carboxylic acid salts Lactams Azacyclic compounds Oxacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic anions

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylpyrrolidine - Isoindolone - Isoindole or derivatives - Isoindoline - Furopyrrole - Benzenoid - 2-pyrrolidone - Pyrrolidone - Monocyclic benzene moiety - Furan - Tertiary carboxylic acid amide - Pyrrole - Oxolane - Dihydrofuran - Carboxylic acid salt - Carboxamide group - Lactam - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Azacycle - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic anion - 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

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