Structure Information
Structure

Compound Identification

SMILES

OCCN(CCO)CN1C(=O)\C(=N/NC(=O)C2=CC(=CC(=C2)[N+]([O-])=O)[N+]([O-])=O)C2=C1C=CC(Cl)=C2

InChIKey

InChIKey=JJGIEMZOIIIAQD-PYCFMQQDSA-N

Formula

C20H19ClN6O8

Mass

506.86

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Indoles and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrobenzene - Benzoic acid or derivatives - Indole or derivatives - Nitroaromatic compound - Benzoyl - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - C-nitro compound - Organic nitro compound - Lactam - Carboxamide group - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Azacycle - Alkanolamine - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Carbonyl group - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indoles and derivatives. These are organic compounds containing an indole, which is a bicyclic ring system made up of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.

External Descriptors

Not available

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