Compound Identification
SMILES
CC1=CC(N=NC2=C(C=C3C=C(NC4=CC5=CC(SOOO)=C(N=NC6=C(OCCO)C=C(N=NC7=CC(=CC8=CC(SOOO)=CC(O)=C78)S(O)(=O)=O)C(C)=C6)C(O)=C5C=C4)C=CC3=C2O)S(O)(=O)=O)=C(OCCO)C=C1N=NC1=CC=CC2=C1C=C(C=C2)S(O)(=O)=O
InChIKey
InChIKey=CWBUALYGHFMEOJ-UHFFFAOYSA-N
Formula
C58H47N9O22S5
Mass
1382.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Level 5
Naphthalene sulfonates
- Level 6 2-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
2-naphthalene sulfonates
Alternative Parents
2-naphthalene sulfonic acids and derivatives Naphthols and derivatives 1-sulfo,2-unsubstituted aromatic compounds Phenoxy compounds Phenol ethers Toluenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Primary aromatic amines Sulfonyls Organosulfonic acids Azo compounds Propargyl-type 1,3-dipolar organic compounds Secondary amines Sulfenyl compounds Organic oxides Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - 1-naphthol - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenol ether - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Toluene - Monocyclic benzene moiety - Primary aromatic amine - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azo compound - Secondary amine - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Ether - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Alcohol - Organosulfur compound - Primary alcohol - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available