Compound Identification
SMILES
OC(=O)C(F)(F)F.FC1=CC(NC(=O)OCC2CC3CCC(C2)N3)=C(C=C1)C1=CSC=C1
InChIKey
InChIKey=LCMGLSLZIBVIMJ-UHFFFAOYSA-N
Formula
C21H22F4N2O4S
Mass
474.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylcarbamic acid esters
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylcarbamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Phenylcarbamic acid esters
Alternative Parents
Tropane alkaloids Fluorobenzenes Aryl fluorides Piperidines Alpha-halocarboxylic acids Thiophenes Carbamate esters Pyrrolidines Heteroaromatic compounds Azacyclic compounds Dialkylamines Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Not available
Substituents
Phenylcarbamic acid ester - Tropane alkaloid - Halobenzene - Fluorobenzene - Piperidine - Aryl fluoride - Aryl halide - Carbamic acid ester - Thiophene - Pyrrolidine - Alpha-halocarboxylic acid - Heteroaromatic compound - Alpha-halocarboxylic acid or derivatives - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Azacycle - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.
External Descriptors
Not available