Structure Information
Structure

Compound Identification

SMILES

[Ca++].COC1=CC=C(NC(=O)C2=CC3=CC=CC=C3C(=NNC3=C(C(Cl)=C(C)C=C3)S(O)(=O)=O)C2=O)C=C1

InChIKey

InChIKey=BDZIKWXQRHITDB-UHFFFAOYSA-N

Formula

C25H20CaClN3O6S

Mass

566.04

Export to:

JSON SDF CSV

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 and derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

2-naphthalenecarboxylic acid or derivatives - Benzenesulfonate - Arylsulfonic acid or derivatives - Anilide - Methoxyaniline - Benzenesulfonyl group - Anisole - Phenoxy compound - Phenol ether - Phenylhydrazine - N-arylamide - Methoxybenzene - Chlorobenzene - Toluene - Halobenzene - Alkyl aryl ether - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Cyclic ketone - Carboxamide group - Secondary carboxylic acid amide - Ketone - Carboxylic acid derivative - Ether - Organic metal halide - Hydrazone - Organosulfur compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organochloride - Organonitrogen compound - Organic cation - Aromatic homopolycyclic compound

Description

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

External Descriptors

Not available

Previous Back Next