Structure Information
Structure

Compound Identification

SMILES

CN(C1=CC=C(Cl)C=C1)S(=O)(=O)C1=CC=C(N2CCNCC2)C2=CC=CC=C12

InChIKey

InChIKey=SEUIBNBABBCEBF-UHFFFAOYSA-N

Formula

C21H22ClN3O2S

Mass

415.94

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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 - N-arylpiperazine - Sulfanilide - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Organosulfonic acid amide - 1,4-diazinane - Piperazine - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary amine - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Secondary amine - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organochloride - Organonitrogen compound - Organosulfur compound - Organic oxide - 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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