Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)C1=CC2=C(N=C(O2)C(=O)COC2=CC=C(OCC(=O)C3=NC4=C(O3)C=C(C3=CC=CC=C43)S(O)(=O)=O)C=C2)C2=CC=CC=C12

InChIKey

InChIKey=ZJZICDKXTREYME-UHFFFAOYSA-N

Formula

C32H20N2O12S2

Mass

688.63

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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 heteropolycyclic compounds

Substituents

1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzoxazole - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Azole - Organosulfonic acid or derivatives - Oxazole - Heteroaromatic compound - Ketone - Azacycle - Oxacycle - Ether - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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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