Compound Identification
SMILES
CC1=CC=C(CCC[N+]2(CCCS(O)(=O)=O)CCOCC2)C=C1
InChIKey
InChIKey=QXOSRXFYFZGYNF-UHFFFAOYSA-O
Formula
C17H28NO4S
Mass
342.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylpropylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpropylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropylamines
Alternative Parents
Toluenes Aralkylamines Morpholines Tetraalkylammonium salts Sulfonyls Organosulfonic acids Alkanesulfonic acids Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpropylamine - Toluene - Aralkylamine - Morpholine - Oxazinane - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tetraalkylammonium salt - Alkanesulfonic acid - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Amine - Organic oxide - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropylamines. These are compounds containing a phenylpropylamine moiety, which consists of a phenyl group substituted at the third carbon by an propan-1-amine.
External Descriptors
Not available