Compound Identification
SMILES
[Li+].[Na+].Cc1ccc(Nc2nc(Cl)nc(Nc3cc(cc4cc(c(N=Nc5cc(C)c(C)cc5S(O)(=O)=O)c(O)c34)S([O-])(=O)=O)S([O-])(=O)=O)n2)c(c1)S(O)(=O)=O
InChIKey
InChIKey=PTGAODIWJYTJJD-UHFFFAOYSA-L
Formula
C28H22ClLiN7NaO13S4
Mass
858.14
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 p-Methylbenzenesulfonates Naphthols and derivatives Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds o-Xylenes Aniline and substituted anilines 1,3,5-triazine-2,4-diamines Toluenes Chloro-s-triazines 1-hydroxy-4-unsubstituted benzenoids Aryl chlorides Sulfonyls Organosulfonic acids Heteroaromatic compounds Azo compounds Secondary amines Propargyl-type 1,3-dipolar organic compounds Organic metal halides Organic lithium salts Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organochlorides Organic sodium salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonate - 2-naphthalene sulfonic acid or derivatives - P-methylbenzenesulfonate - 1-naphthol - Benzenesulfonate - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - 2,4-diamine-s-triazine - O-xylene - Xylene - Aniline or substituted anilines - Chloro-s-triazine - 1-hydroxy-4-unsubstituted benzenoid - Halo-s-triazine - Toluene - Aminotriazine - Amino-1,3,5-triazine - 1,3,5-triazine - Triazine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azo compound - Organic metal halide - Organic lithium salt - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - 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