Compound Identification
SMILES
FC1=C(C=CC(=C1)N1C=CC=CC1=O)N1CCCC(NS(=O)(=O)C2=CC3=C(C=C2)C=C(Cl)C=C3)C1=O
InChIKey
InChIKey=ZZCDITNUCFNEMT-UHFFFAOYSA-N
Formula
C26H21ClFN3O4S
Mass
525.98
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 Phenylpiperidines Chloronaphthalenes Alpha amino acids and derivatives Pyridinones Piperidinones Fluorobenzenes Dihydropyridines Delta lactams Organosulfonamides Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonamide - Naphthalene sulfonamide - 2-naphthalene sulfonic acid or derivatives - Phenylpiperidine - Chloronaphthalene - Alpha-amino acid or derivatives - Delta-lactam - Dihydropyridine - Fluorobenzene - Halobenzene - Piperidinone - Pyridinone - Organosulfonic acid amide - Monocyclic benzene moiety - Pyridine - Aryl halide - Piperidine - Aryl chloride - Aryl fluoride - Hydropyridine - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Aminosulfonyl compound - Carboxamide group - Lactam - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organochloride - 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