[(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 3-(tert-butylsulfamoyl)benzoate

Systemtic Name: [(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 3-(tert-butylsulfamoyl)benzoate Openeye Name: [(1R)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 3-(tert-butylsulfamoyl)benzoate CAS Name: 3-(tert-butylsulfamoyl)benzoic acid [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] 3-(tert-butylsulfamoyl)benzoate Traditional Name: 3-(tert-butylsulfamoyl)benzoic acid [(1R)-2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC1CCCCCC1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C21H32N2O5S/c1-15(19(24)22-17-11-7-5-6-8-12-17)28-20(25)16-10-9-13-18(14-16)29(26,27)23-21(2,3)4/h9-10,13-15,17,23H,5-8,11-12H2,1-4H3,(H,22,24)/t15-/m1/s1