[(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-3-(methylsulfamoyl)benzoate

Systemtic Name: [(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-3-(methylsulfamoyl)benzoate Openeye Name: [(1R)-2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 4-chloro-3-(methylsulfamoyl)benzoate CAS Name: 4-chloro-3-(methylsulfamoyl)benzoic acid [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 4-chloro-3-(methylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(methylsulfamoyl)benzoic acid [(1R)-2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H25ClN2O5S MolecularWeight: 416.9195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC

Isomeric SMILES

C[C@H](C(=O)NCC1CCCCC1)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC

InChI

InChI=1S/C18H25ClN2O5S/c1-12(17(22)21-11-13-6-4-3-5-7-13)26-18(23)14-8-9-15(19)16(10-14)27(24,25)20-2/h8-10,12-13,20H,3-7,11H2,1-2H3,(H,21,22)/t12-/m1/s1