Structure Information
Structure

Compound Identification

SMILES

[Na+].Oc1c(Cl)cc(cc1\N=N\c1ccc2c(cccc2c1O)S([O-])(=O)=O)[N+]([O-])=O

InChIKey

InChIKey=CQOINLYSGRJZFD-LTRPLHCISA-M

Formula

C16H9ClN3NaO7S

Mass

445.76

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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

1-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - 1-naphthol - Nitrophenol - 1-sulfo,2-unsubstituted aromatic compound - Nitrobenzene - Arylsulfonic acid or derivatives - 2-halophenol - Nitroaromatic compound - 2-chlorophenol - Halobenzene - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Chlorobenzene - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Organosulfonic acid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Azo compound - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic metal halide - Organic alkali metal salt - Organic 1,3-dipolar compound - Organic oxoazanium - Organic salt - Organic sodium salt - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organosulfur compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group 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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