ethyl 6-[(4-chloranyl-2-fluoranyl-phenyl)sulfamoyl]-3-phenyl-cyclohexene-1-carboxylate

Systemtic Name: ethyl 6-[(4-chloranyl-2-fluoranyl-phenyl)sulfamoyl]-3-phenyl-cyclohexene-1-carboxylate Openeye Name: ethyl 6-[(4-chloro-2-fluoro-phenyl)sulfamoyl]-3-phenyl-cyclohexene-1-carboxylate CAS Name: 6-[(4-chloro-2-fluorophenyl)sulfamoyl]-3-phenyl-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-chloro-2-fluorophenyl)sulfamoyl]-3-phenylcyclohexene-1-carboxylate Traditional Name: 6-[(4-chloro-2-fluoro-phenyl)sulfamoyl]-3-phenyl-cyclohexene-1-carboxylic acid ethyl ester Formula: C21H21ClFNO4S MolecularWeight: 437.912143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(CCC1S(=O)(=O)NC2=C(C=C(C=C2)Cl)F)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(CCC1S(=O)(=O)NC2=C(C=C(C=C2)Cl)F)C3=CC=CC=C3

InChI

InChI=1S/C21H21ClFNO4S/c1-2-28-21(25)17-12-15(14-6-4-3-5-7-14)8-11-20(17)29(26,27)24-19-10-9-16(22)13-18(19)23/h3-7,9-10,12-13,15,20,24H,2,8,11H2,1H3