Compound Identification
SMILES
COC1=CC(OC)=C(C=C1)N1CCN(CC1)S(=O)(=O)C1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=MILISDLZCGBUHG-UHFFFAOYSA-N
Formula
C22H24N2O4S
Mass
412.5
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
1-naphthalene sulfonic acids and derivatives
Alternative Parents
1-naphthalene sulfonamides Phenylpiperazines N-arylpiperazines Dimethoxybenzenes Methoxyanilines Aminophenyl ethers Phenoxy compounds Dialkylarylamines Anisoles Alkyl aryl ethers Organosulfonamides Sulfonyls Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - N-arylpiperazine - Phenylpiperazine - Dimethoxybenzene - M-dimethoxybenzene - Aminophenyl ether - Methoxyaniline - Tertiary aliphatic/aromatic amine - Phenoxy compound - Anisole - Dialkylarylamine - Aniline or substituted anilines - Phenol ether - Methoxybenzene - Alkyl aryl ether - Organosulfonic acid amide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Organosulfonic acid or derivatives - Sulfonyl - Organic sulfonic acid or derivatives - Tertiary amine - Organoheterocyclic compound - Azacycle - Ether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-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 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available