Compound Identification
SMILES
[O-]S(=O)(=O)C(F)(F)F.C[N@+]1(CC2=CC=CC=C2)C[C@H]([C@@H]1C#N)C1=CC=CC=C1
InChIKey
InChIKey=XXRQUENTJWKMBX-ASBZXGSUSA-M
Formula
C19H19F3N2O3S
Mass
412.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azetidines
- Subclass Phenylazetidines
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Class
Azetidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azetidines
Subclass
Phenylazetidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylazetidines
Alternative Parents
Trifluoromethanesulfonates Benzylamines Phenylmethylamines Aralkylamines Tetraalkylammonium salts Methanesulfonates Organosulfonic acids Sulfonyls Alpha-aminonitriles Trihalomethanes Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides Organic cations
Molecular Framework
Not available
Substituents
3-phenylazetidine - Benzylamine - Trifluoromethanesulfonate - Phenylmethylamine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Methanesulfonate - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Alkanesulfonic acid - Tetraalkylammonium salt - Trihalomethane - Alpha-aminonitrile - Carbonitrile - Nitrile - Azacycle - Halomethane - Organic oxide - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylazetidines. These are polycyclic aromatic compounds containing a phenyl ring substituted with an azetidine ring.
External Descriptors
Not available