Compound Identification
SMILES
Br.COC1=C(F)C=C(C=C1)N(CC1=CSC=C1)C(=O)O[C@H]1C[N+]2(C\C=C\C3=CC=CC=C3)CCC1CC2
InChIKey
InChIKey=HLMDMIGUSFMLRK-OHQHPXSVSA-N
Formula
C29H33BrFN2O3S
Mass
588.56
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
Methoxyanilines Anisoles Methoxybenzenes Phenoxy compounds Quinuclidines Styrenes Fluorobenzenes Alkyl aryl ethers Piperidines Aryl fluorides Thiophenes Heteroaromatic compounds Carbamate esters Tetraalkylammonium salts Azacyclic compounds Organofluorides Organic oxides Amines Hydrocarbon derivatives Hydrobromides Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylcarbamic acid ester - Methoxyaniline - Anisole - Phenol ether - Quinuclidine - Styrene - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Piperidine - Tetraalkylammonium salt - Heteroaromatic compound - Carbamic acid ester - Thiophene - Quaternary ammonium salt - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Hydrobromide - Organic oxide - Organic cation - 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