[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-chlorophenyl)sulfonylamino]propanoic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]propionic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H23ClN2O5S MolecularWeight: 390.88222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)CCNS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)CCNS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H23ClN2O5S/c1-11(2)10-18-16(21)12(3)24-15(20)8-9-19-25(22,23)14-6-4-13(17)5-7-14/h4-7,11-12,19H,8-10H2,1-3H3,(H,18,21)/t12-/m0/s1