Compound Identification
SMILES
[Na+].[Na+].[Na+].OS(=O)(=O)C1=CC2=CC(=CC(NC3=NC(Cl)=NC(NC4=CC(=CC=C4)S(=O)(=O)C=C)=N3)=C2C([O-])=C1N=NC1=CC=CC=C1S([O-])(=O)=O)S([O-])(=O)=O
InChIKey
InChIKey=WXEMTGZUJRMGSK-UHFFFAOYSA-K
Formula
C27H17ClN7Na3O12S4
Mass
864.13
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 Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds 1,3,5-triazine-2,4-diamines Aniline and substituted anilines Phenoxides Chloro-s-triazines Aryl chlorides Sulfones Organosulfonic acids Heteroaromatic compounds Azo compounds Organic metal halides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Organic sodium salts Organochlorides Organooxygen compounds Amines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - 2,4-diamine-s-triazine - Aniline or substituted anilines - Amino-1,3,5-triazine - Chloro-s-triazine - Halo-s-triazine - Aminotriazine - Phenoxide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazine - 1,3,5-triazine - Sulfone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Organosulfonic acid - Sulfonyl - Azo compound - Organic alkali metal salt - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic metal halide - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organic sodium salt - Organic salt - Organic oxide - Amine - Organic nitrogen compound - Hydrocarbon derivative - 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