Compound Identification
SMILES
[Na+].NC1=CC=C(C=C1)C1=NC2=C(O1)C=C(C1=CC=CC=C21)S(O)(=O)=O
InChIKey
InChIKey=NOFKXFAAMBTFCU-UHFFFAOYSA-N
Formula
C17H12N2NaO4S
Mass
363.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Level 5
Naphthalene sulfonates
- Level 6 1-naphthalene sulfonates
-
Level 5
Naphthalene sulfonates
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Naphthalene sulfonates
Direct Parent
1-naphthalene sulfonates
Alternative Parents
1-naphthalene sulfonic acids and derivatives Phenyl-1,3-oxazoles 1-sulfo,2-unsubstituted aromatic compounds Benzoxazoles Aniline and substituted anilines Sulfonyls Organosulfonic acids Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organic alkali metal salts Organic oxides Primary amines Hydrocarbon derivatives Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - Phenyl-1,3-oxazole - Arylsulfonic acid or derivatives - Benzoxazole - 1-sulfo,2-unsubstituted aromatic compound - Aniline or substituted anilines - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Oxazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Oxacycle - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Primary amine - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available