Structure Information
Structure

Compound Identification

SMILES

CC(C)(C(=O)NNCCCCN)C1=CN2C=C(N=C(CCCCN)C2=N1)C1=CC(=C(Cl)C=C1)[N+]([O-])=O

InChIKey

InChIKey=HHCVZTKSQHZMPD-UHFFFAOYSA-N

Formula

C24H33ClN8O3

Mass

517.03

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrobenzene - Imidazopyrazine - Nitroaromatic compound - Halobenzene - Chlorobenzene - Aralkylamine - Aryl chloride - Aryl halide - N-substituted imidazole - Pyrazine - Azole - Imidazole - Heteroaromatic compound - Carboxylic acid hydrazide - Organic nitro compound - C-nitro compound - Amino acid or derivatives - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Amine - Organohalogen compound - Organochloride - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Organic zwitterion - Organic salt - Carbonyl group - 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 nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

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