[(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-phenylsulfanylpropanoate

Systemtic Name: [(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-phenylsulfanylpropanoate Openeye Name: [(1R)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] (2S)-2-phenylsulfanylpropanoate CAS Name: (2S)-2-(phenylthio)propanoic acid [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] (2S)-2-phenylsulfanylpropanoate Traditional Name: (2S)-2-(phenylthio)propionic acid [(1R)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethyl] ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC(=O)C(C)SC1=CC=CC=C1

Isomeric SMILES

C[C@H](C(=O)NCCOC)OC(=O)[C@H](C)SC1=CC=CC=C1

InChI

InChI=1S/C15H21NO4S/c1-11(14(17)16-9-10-19-3)20-15(18)12(2)21-13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,16,17)/t11-,12+/m1/s1