Structure Information
Structure

Compound Identification

SMILES

CC(=O)O[C@@]1(C)OC(=O)[C@]2(N(C(C)=O)C(C)=C(C#N)[C@@]12C#N)C1=CC=CC=C1

InChIKey

InChIKey=HIHQIIJIMMXQSB-SLFFLAALSA-N

Formula

C20H17N3O5

Mass

379.372

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolines

Subclass

Phenylpyrrolines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylpyrroline - Alpha-amino acid or derivatives - Ketal - Acylal - Fatty acid ester - Fatty acyl - Benzenoid - Gamma butyrolactone - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Acetamide - Tetrahydrofuran - Tertiary carboxylic acid amide - Pyrrole - Lactone - Carboxylic acid ester - Carboxamide group - Oxacycle - Azacycle - Nitrile - Carbonitrile - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.

External Descriptors

Not available

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