Compound Identification
SMILES
Cl.CC(=O)C1=CC(NS(=O)(=O)C2=CC=C(N3CCNCC3)C3=CC=CC=C23)=CC=C1
InChIKey
InChIKey=CYNNNFLJXYCSSV-UHFFFAOYSA-N
Formula
C22H24ClN3O3S
Mass
445.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
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
1-naphthalene sulfonamides Alkyl-phenylketones N-arylpiperazines Sulfanilides Acetophenones Dialkylarylamines Benzoyl derivatives Aryl alkyl ketones Organosulfonamides Aminosulfonyl compounds Dialkylamines Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Alkyl-phenylketone - N-arylpiperazine - Sulfanilide - Acetophenone - Phenylketone - Tertiary aliphatic/aromatic amine - Benzoyl - Aryl ketone - Aryl alkyl ketone - Dialkylarylamine - 1,4-diazinane - Monocyclic benzene moiety - Organosulfonic acid amide - Piperazine - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Tertiary amine - Ketone - Secondary aliphatic amine - Azacycle - Secondary amine - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organosulfur compound - Hydrochloride - Organic oxygen 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