Structure Information
Structure

Compound Identification

SMILES

[Ca++].CCc1cc(\N=N\c2c(O)cc(C([O-])=O)c3ccccc23)c(cc1Cl)S([O-])(=O)=O

InChIKey

InChIKey=XFBYVZFACYDNIR-QUABFQRHSA-L

Formula

C19H13CaClN2O6S

Mass

472.91

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalenecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Naphthalenecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-naphthalenecarboxylic acid - 2-naphthol - Benzenesulfonate - Hydroxybenzoic acid - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Halobenzene - Chlorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Organosulfonic acid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Azo compound - Carboxylic acid salt - Carboxylic acid - Organic 1,3-dipolar compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic metal halide - Organic calcium salt - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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