[(1S)-1-phenylethyl] (6R)-6-[(2-chloranyl-4-fluoranyl-phenyl)sulfamoyl]cyclohexene-1-carboxylate

Systemtic Name: [(1S)-1-phenylethyl] (6R)-6-[(2-chloranyl-4-fluoranyl-phenyl)sulfamoyl]cyclohexene-1-carboxylate Openeye Name: [(1S)-1-phenylethyl] (6R)-6-[(2-chloro-4-fluoro-phenyl)sulfamoyl]cyclohexene-1-carboxylate CAS Name: (6R)-6-[(2-chloro-4-fluorophenyl)sulfamoyl]-1-cyclohexenecarboxylic acid [(1S)-1-phenylethyl] ester IUPAC Name: [(1S)-1-phenylethyl] (6R)-6-[(2-chloro-4-fluorophenyl)sulfamoyl]cyclohexene-1-carboxylate Traditional Name: (6R)-6-[(2-chloro-4-fluoro-phenyl)sulfamoyl]cyclohexene-1-carboxylic acid [(1S)-1-phenylethyl] ester Formula: C21H21ClFNO4S MolecularWeight: 437.912143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=CCCCC2S(=O)(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)OC(=O)C2=CCCC[C@H]2S(=O)(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFNO4S/c1-14(15-7-3-2-4-8-15)28-21(25)17-9-5-6-10-20(17)29(26,27)24-19-12-11-16(23)13-18(19)22/h2-4,7-9,11-14,20,24H,5-6,10H2,1H3/t14-,20+/m0/s1