Structure Information
Structure

Compound Identification

SMILES

NC(=O)CCCC(O)=O.COC(=O)C1=C(C)N2C(C)=C2C1C1=CC=CC=C1[N+]([O-])=O

InChIKey

InChIKey=JCGNXKUBHHVMSG-UHFFFAOYSA-N

Formula

C20H23N3O7

Mass

417.418

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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

Not available

Substituents

3-phenylpyrroline - Nitrobenzene - Nitroaromatic compound - Dihydropyridine - Monocyclic benzene moiety - Straight chain fatty acid - Fatty acyl - Fatty acid - Fatty amide - Benzenoid - Pyrrole - Methyl ester - Enoate ester - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - C-nitro compound - Organic nitro compound - Primary carboxylic acid amide - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Amino acid or derivatives - Azirine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Enamine - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Amine - Organic oxygen compound - Organic salt - Carbonyl group - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic cation - 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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