Compound Identification
SMILES
CC1=CC2=NC(=C(NCC3=CC=CC=C3)N2C=C1)C1=CC=C(OS(=O)(=O)C2=CC=CC3=CC=CC=C23)C=C1
InChIKey
InChIKey=OMBBVFLPGBSCID-UHFFFAOYSA-N
Formula
C31H25N3O3S
Mass
519.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Level 5
Naphthalene sulfonates
- Level 6 1-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
1-naphthalene sulfonates
Alternative Parents
1-naphthalene sulfonic acids and derivatives Phenylimidazoles Imidazopyridines Imidazo[1,2-a]pyridines Arylsulfonic acids and derivatives Phenoxy compounds Benzylamines Methylpyridines Organosulfonic acid esters Aminoimidazoles N-substituted imidazoles Sulfonyls Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Amines Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - 5-phenylimidazole - 4-phenylimidazole - Arylsulfonic acid or derivatives - Imidazo[1,2-a]pyridine - Imidazopyridine - Phenoxy compound - Benzylamine - Methylpyridine - Aminoimidazole - Monocyclic benzene moiety - N-substituted imidazole - Organosulfonic acid ester - Pyridine - Azole - Imidazole - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Amine - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available