Compound Identification
SMILES
[H+].[Na+].[Na+].[Cr+3].COC1=NC(Cl)=NC(NC2=CC3=CC(=C(N=NC4=CC=CC=C4C([O-])=O)C([O-])=C3C=C2)S([O-])(=O)=O)=N1.COC1=NC(Cl)=NC(NC2=CC3=CC(=C(N=NC4=CC=CC=C4C([O-])=O)C([O-])=C3C=C2)S([O-])(=O)=O)=N1
InChIKey
InChIKey=XDEIRYCOKSRFES-UHFFFAOYSA-I
Formula
C42H25Cl2CrN12Na2O14S2
Mass
1154.73
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
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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 1-sulfo,2-unsubstituted aromatic compounds Benzoic acids 2-methoxy-1,3,5-triazines Benzoyl derivatives Phenoxides Alkyl aryl ethers Aminotriazines Chloro-s-triazines Aryl chlorides Organosulfonic acids Sulfonyls Heteroaromatic compounds Amino acids Azo compounds Carboxylic acid salts Secondary amines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic metal halides Organic oxides Organic sodium salts Hydrocarbon derivatives Organochlorides Organic chromium salts Organic cations
Molecular Framework
Not available
Substituents
2-naphthalene sulfonate - 2-naphthalene sulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid - Benzoic acid or derivatives - Arylsulfonic acid or derivatives - 2-methoxy-1,3,5-triazine - Benzoyl - Alkoxy-s-triazine - Amino-1,3,5-triazine - Chloro-s-triazine - Halo-s-triazine - Alkyl aryl ether - Phenoxide - Aminotriazine - Monocyclic benzene moiety - 1,3,5-triazine - Triazine - Aryl halide - Aryl chloride - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Amino acid or derivatives - Amino acid - Azo compound - Carboxylic acid salt - Propargyl-type 1,3-dipolar organic compound - Organic metal halide - Organic 1,3-dipolar compound - Organoheterocyclic compound - Secondary amine - Organic transition metal salt - Azacycle - Organic alkali metal salt - Carboxylic acid derivative - Ether - Carboxylic acid - Organic sodium salt - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic oxide - Organic chromium salt - Amine - Organic salt - Organic cation - Aromatic heteropolycyclic 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