Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=C(N)C=C1)C(=O)NC1=C2C(=CC(=C1)S(O)(=O)=O)C=C(C=C2S(O)(=O)=O)S(O)(=O)=O

InChIKey

InChIKey=FIFNFAQOMMFYHP-UHFFFAOYSA-N

Formula

C18H16N2O10S3

Mass

516.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Naphthalene sulfonates

Direct Parent

2-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - 1-naphthalene sulfonate - 2-naphthalene sulfonic acid or derivatives - Aminobenzoic acid or derivatives - Arylsulfonic acid or derivatives - Benzamide - O-toluamide - Toluamide - Benzoic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzoyl - Aminotoluene - Aniline or substituted anilines - Toluene - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Organonitrogen compound - Amine - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Organosulfur compound - Primary amine - Organic nitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group 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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