Compound Identification
SMILES
NC1=C(N=NC2=CC=C(C=C2)C2=CC=C(NN=C3C=CC(=O)C(=C3)C(O)=O)C=C2)C2=C(C=C1)C=CC(=C2)S(O)(=O)=O
InChIKey
InChIKey=MKTOGNQDCHHDOL-UHFFFAOYSA-N
Formula
C29H21N5O6S
Mass
567.58
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 Biphenyls and derivatives 1-sulfo,2-unsubstituted aromatic compounds Phenylhydrazines Organosulfonic acids Sulfonyls Cyclic ketones Azo compounds Amino acids Monocarboxylic acids and derivatives Hydrazones Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Biphenyl - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenylhydrazine - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid - Cyclic ketone - Amino acid or derivatives - Azo compound - Ketone - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Hydrazone - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Amine - Primary amine - Organic nitrogen compound - 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