Structure Information
Structure

Compound Identification

SMILES

CCN(CC)C(=C/C(=O)OC)\N1C([O-])=C([N+]#N)C2=CC=CC=C12

InChIKey

InChIKey=YMYSXWQSSLNMGL-JLHYYAGUSA-N

Formula

C16H18N4O3

Mass

314.345

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indoles

Intermediate Tree Nodes

Not available

Direct Parent

Indoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole - Substituted pyrrole - Benzenoid - Pyrrole - Acrylic acid or derivatives - Methyl ester - Heteroaromatic compound - Enoate ester - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Amino acid or derivatives - Carboxylic acid ester - Ketene acetal or derivatives - Organic diazonium salt - Tertiary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.

External Descriptors

Not available

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