Structure Information
Structure

Compound Identification

SMILES

[Br-].COC1=CC(N)=C(Cl)C=C1C(=O)OCC[N+]12CCC(CC1)CC2

InChIKey

InChIKey=SWPBPOUEWMYAHO-UHFFFAOYSA-N

Formula

C17H24BrClN2O3

Mass

419.74

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Methoxybenzoic acids and derivatives

Direct Parent

O-methoxybenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

O-methoxybenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Aminobenzoic acid or derivatives - Benzoate ester - Aminophenyl ether - Methoxyaniline - Phenol ether - Quinuclidine - Phenoxy compound - Benzoyl - Aniline or substituted anilines - Anisole - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Piperidine - Aryl halide - Aryl chloride - Tetraalkylammonium salt - Quaternary ammonium salt - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxide - Primary amine - Organic zwitterion - Organic oxygen compound - Organic salt - Amine - Organic bromide salt - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as o-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 2 of the benzene ring is replaced by a methoxy group.

External Descriptors

Not available

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