[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 4-(phenylsulfonylamino)benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 4-(phenylsulfonylamino)benzoate Openeye Name: [(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl] 4-(benzenesulfonamido)benzoate CAS Name: 4-(benzenesulfonamido)benzoic acid [(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl] 4-(benzenesulfonamido)benzoate Traditional Name: 4-(benzenesulfonamido)benzoic acid [(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)OC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)OC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22N2O5S/c1-13(2)20-18(22)14(3)26-19(23)15-9-11-16(12-10-15)21-27(24,25)17-7-5-4-6-8-17/h4-14,21H,1-3H3,(H,20,22)/t14-/m0/s1