Compound Identification
SMILES
CC1=NC(NS(=O)(=O)C2=CC3=C(Br)C=C(O)C(C)=C3C=C2)=C(O)C=C1
InChIKey
InChIKey=YJOZMRVYNNKIQI-UHFFFAOYSA-N
Formula
C17H15BrN2O4S
Mass
423.28
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
2-naphthalene sulfonic acids and derivatives
Alternative Parents
2-naphthalene sulfonamides Naphthols and derivatives M-bromophenols 1-hydroxy-2-unsubstituted benzenoids Methylpyridines Hydroxypyridines Organosulfonamides Aryl bromides Imidolactams Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organic oxides Organobromides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 2-naphthalene sulfonamide - 2-naphthol - 3-halophenol - 3-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Methylpyridine - Hydroxypyridine - Phenol - Aryl bromide - Aryl halide - Pyridine - Imidolactam - Organosulfonic acid amide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available