Structure Information
Structure

Compound Identification

SMILES

CCC(=O)N1N=C2[C@@H]([C@@H]1C1=CC=C(C=C1)[N+]([O-])=O)N1CCC2CC1

InChIKey

InChIKey=SUQLDIGMLLWLIT-IRXDYDNUSA-N

Formula

C17H20N4O3

Mass

328.372

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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 - Nitroaromatic compound - Quinuclidine - Aralkylamine - Piperidine - Pyrazoline - Amino acid or derivatives - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - N-alkylated hydrazone - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Amine - 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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