Compound Identification
SMILES
CCOC(=O)N1CC[C@H](NS(=O)(=O)C2=CC=C(NC(=O)C3=CC=CC=C3C)C3=CC=CC=C23)[C@@H](C)C1
InChIKey
InChIKey=ZIOCSXNTHJDZSC-CVDCTZTESA-N
Formula
C27H31N3O5S
Mass
509.62
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 o-Toluamides Piperidinecarboxylic acids Benzamides Benzoyl derivatives Organosulfonamides Carbamate esters Aminosulfonyl compounds Secondary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Benzamide - Benzoic acid or derivatives - Piperidinecarboxylic acid - Toluamide - O-toluamide - Benzoyl - Toluene - Monocyclic benzene moiety - Piperidine - Organosulfonic acid amide - Aminosulfonyl compound - Carbamic acid ester - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - 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