Structure Information
Structure

Compound Identification

SMILES

CC1=C2C=CC(=CC2=C(Br)C=C1O)S(=O)(=O)NC1=NC(=O)NC(=O)N1

InChIKey

InChIKey=VFRQCMCSVZTGFH-UHFFFAOYSA-N

Formula

C14H11BrN4O5S

Mass

427.23

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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

2-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-naphthalene sulfonamide - Naphthalene sulfonamide - 2-naphthalene sulfonic acid or derivatives - 2-naphthol - 3-halophenol - 3-bromophenol - Amino-1,3,5-triazine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Triazinone - Aryl bromide - Organosulfonic acid amide - Triazine - Aryl halide - 1,3,5-triazine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Heteroaromatic compound - Sulfonyl - Urea - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-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 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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