Compound Identification
SMILES
OC(=O)C1=C(O)C(=O)N=C(N1)C1=CC=CC=C1NS(=O)(=O)C1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=ZIIGYWFCPBJHNH-UHFFFAOYSA-N
Formula
C21H15N3O6S
Mass
437.43
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 Sulfanilides Hydropyrimidine carboxylic acids and derivatives Pyrimidinecarboxylic acids Pyrimidones Hydroxypyrimidines Organosulfonamides Vinylogous amides Aminosulfonyl compounds Heteroaromatic compounds Vinylogous acids Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organooxygen compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 1-naphthalene sulfonamide - Sulfanilide - Hydropyrimidine carboxylic acid derivative - Pyrimidine-6-carboxylic acid - Pyrimidine-6-carboxylic acid or derivatives - Hydroxypyrimidine - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Organosulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Vinylogous acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous amide - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen 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