Compound Identification
SMILES
CC1(C)C(\C=C\C2=C(Cl)\C(\CCC2)=C\C=C2/C(C)(C)C3=C(C=CC4=C3C=CC(=C4)S([O-])(=O)=O)[N+]22CC2S([O-])(=O)=O)=[N+](CCS([O-])(=O)=O)C2=C1C1=C(C=C2)C=C(SOO[O-])C=C1
InChIKey
InChIKey=BGCFMFCXEGHJHK-GLBUPSBOSA-L
Formula
C42H39ClN2O12S4
Mass
927.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
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
-
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 3-alkylindoles 1-sulfo,2-unsubstituted aromatic compounds Sulfonyls Organosulfonic acids Alkanesulfonic acids N-vinylaziridines Vinyl chlorides Sulfenyl compounds Azacyclic compounds Chloroalkenes Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - 3-alkylindole - Arylsulfonic acid or derivatives - Indole or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - N-vinylaziridine - Vinylaziridine - Azacycle - Chloroalkene - Haloalkene - Sulfenyl compound - Organoheterocyclic compound - Vinyl halide - Vinyl chloride - Aziridine - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organochloride - Organic salt - Organic oxide - Organohalogen compound - 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