Structure Information
Structure

Compound Identification

SMILES

[Na+].C[C@H](O)C1C2SC(CN3C4=CC=CC5=C4C(=CC=C5)S3(=O)=O)=C(N2C1=O)C([O-])=O

InChIKey

InChIKey=LNLZRYJAQFUQNO-SMPGBHRRSA-M

Formula

C19H15N2NaO6S2

Mass

454.45

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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 sulfonic acid or derivatives - Naphthalene sulfonamide - 1-naphthalene sulfonamide - Alpha-amino acid or derivatives - 1,2-benzothiazole - Thiazolecarboxylic acid or derivatives - Penem - Organosulfonic acid amide - Vinylogous thioester - Beta-lactam - Tertiary carboxylic acid amide - Thiazole - Meta-thiazoline - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Thioenolether - Secondary alcohol - Lactam - Carboxylic acid salt - Carboxamide group - Azetidine - Azacycle - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Hemithioaminal - Organic sodium salt - Organic oxygen compound - Organic nitrogen compound - Alcohol - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic salt - Organic zwitterion - Carbonyl group - 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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