Structure Information
Structure

Compound Identification

SMILES

[Br-].CCC([NH3+])(CC)CCCN(CC1=CC=C(OC)C=C1)C(=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=ZRKNRQYBMMNLPL-UHFFFAOYSA-N

Formula

C23H32BrN3O4

Mass

494.43

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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 homomonocyclic compounds

Substituents

Benzamide - Benzoic acid or derivatives - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Quaternary ammonium salt - Tertiary carboxylic acid amide - Amino acid or derivatives - Organic nitro compound - Carboxamide group - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Ether - Primary amine - Organic salt - Organic oxygen compound - Primary aliphatic amine - Organic bromide salt - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic cation - Aromatic homomonocyclic 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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