Structure Information
Structure

Compound Identification

SMILES

CCC(C)N(CC(=O)C1=C(NN(C1=O)C1=CC=CC=C1)C1=CC=CC=C1)S(=O)(=O)C1=CC=CC2=CC=CC=C12

InChIKey

InChIKey=ZDDMSKRGQCECKX-UHFFFAOYSA-N

Formula

C31H29N3O4S

Mass

539.65

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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 - Phenylpyrazole - Aryl ketone - Aryl alkyl ketone - Monocyclic benzene moiety - Pyrazolinone - Organosulfonic acid amide - Azole - Pyrazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Heteroaromatic compound - Vinylogous amide - Ketone - Lactam - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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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