Compound Identification
SMILES
ClC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)N1CCN(CC1)C(=O)C1=NC=C(C=C1)C1=CC=NC=C1
InChIKey
InChIKey=UNMQSEKRWUCDJA-UHFFFAOYSA-N
Formula
C25H21ClN4O3S
Mass
492.98
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
2-naphthalene sulfonic acids and derivatives
Alternative Parents
2-naphthalene sulfonamides Bipyridines and oligopyridines Chloronaphthalenes Pyridinecarboxylic acids and derivatives 2-heteroaryl carboxamides Aryl chlorides Piperazines Organosulfonamides Heteroaromatic compounds Tertiary carboxylic acid amides Sulfonyls Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 2-naphthalene sulfonamide - Bipyridine - Chloronaphthalene - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aryl chloride - Aryl halide - Pyridine - 1,4-diazinane - Organosulfonic acid amide - Piperazine - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Carboxamide group - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-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 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available