Structure Information
Structure

Compound Identification

SMILES

[Cl-].C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(CN3C4=CC=CC5=CC(C[N+]67CC[N+](CC(N)=O)(CC6)CC7)=CC(=C45)S3(=O)=O)=C(N2C1=O)C([O-])=O

InChIKey

InChIKey=ASBPPMPRVANAEA-PTFJVRJWSA-N

Formula

C30H36ClN5O7S

Mass

646.16

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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 - Alpha-amino acid amide - Carbapenem - Alpha-amino acid or derivatives - N-piperazineacetamide - 1,2-benzothiazole - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Aralkylamine - N-alkylpiperazine - Organosulfonic acid amide - 1,4-diazinane - Piperazine - Beta-lactam - Tetraalkylammonium salt - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Quaternary ammonium salt - Pyrroline - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary alcohol - Lactam - Primary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Alcohol - Organic oxygen compound - Organic salt - Carbonyl group - Amine - Organic chloride salt - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - 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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