ethyl 6-[[2,4-bis(fluoranyl)phenyl]sulfamoyl]-3-tert-butyl-cyclohexene-1-carboxylate

Systemtic Name: ethyl 6-[[2,4-bis(fluoranyl)phenyl]sulfamoyl]-3-tert-butyl-cyclohexene-1-carboxylate Openeye Name: ethyl 3-tert-butyl-6-[(2,4-difluorophenyl)sulfamoyl]cyclohexene-1-carboxylate CAS Name: 3-tert-butyl-6-[(2,4-difluorophenyl)sulfamoyl]-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-tert-butyl-6-[(2,4-difluorophenyl)sulfamoyl]cyclohexene-1-carboxylate Traditional Name: 3-tert-butyl-6-[(2,4-difluorophenyl)sulfamoyl]cyclohexene-1-carboxylic acid ethyl ester Formula: C19H25F2NO4S MolecularWeight: 401.467906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25F2NO4S/c1-5-26-18(23)14-10-12(19(2,3)4)6-9-17(14)27(24,25)22-16-8-7-13(20)11-15(16)21/h7-8,10-12,17,22H,5-6,9H2,1-4H3