Compound Identification
SMILES
[Na+].NC1=C(N=NC2=C(OC3=CC=CC=C3Cl)C=CC(Cl)=C2)C2=C([O-])C=C(C=C2C=C1)S(O)(=O)=O
InChIKey
InChIKey=FDVVINSONWRBSI-UHFFFAOYSA-M
Formula
C22H14Cl2N3NaO5S
Mass
526.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
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Level 5
Naphthalene sulfonates
- Level 6 2-naphthalene sulfonates
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Level 5
Naphthalene sulfonates
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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 Diphenylethers Diarylethers 1-sulfo,2-unsubstituted aromatic compounds Phenoxy compounds Phenol ethers Chlorobenzenes Phenoxides Aryl chlorides Sulfonyls Organosulfonic acids Azo compounds Organic metal halides Propargyl-type 1,3-dipolar organic compounds Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Primary amines Organochlorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Diphenylether - Diaryl ether - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenol ether - Phenoxy compound - Chlorobenzene - Halobenzene - Phenoxide - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Azo compound - Organic metal halide - Organic alkali metal salt - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic salt - Organic nitrogen compound - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic oxygen compound - Amine - Primary amine - Organic zwitterion - 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