Compound Identification
SMILES
CC(=O)CCC(C(=C)CNCC1=CC=CC=C1)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=HAHFHRCEIPHGTE-UHFFFAOYSA-N
Formula
C22H27NO3S
Mass
385.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Tosyl compounds
-
Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Tosyl compounds
Alternative Parents
Benzenesulfonyl compounds Phenylmethylamines Benzylamines Aralkylamines Sulfones Ketones Dialkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Tosyl compound - Benzenesulfonyl group - Benzylamine - Phenylmethylamine - Aralkylamine - Sulfone - Sulfonyl - Ketone - Secondary aliphatic amine - Secondary amine - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as tosyl compounds. These are organosulfur compounds containing a tosyl group, with the general formula CH3C6H4S(O2)R (R = any atom).
External Descriptors
Not available