Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=C(NS(=O)(=O)C2=C3C=CC=C4C(=O)SC(C=C2)=C34)C=C1

InChIKey

InChIKey=WAKIIHAZVVCGPA-UHFFFAOYSA-N

Formula

C17H10BrNO3S2

Mass

420.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

1-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Sulfanilide - Aryl thioether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Organosulfonic acid amide - Sulfonyl - Carbothioic s-lactone - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Thiocarboxylic acid ester - Thiocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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