methyl (5S)-5-[(2S)-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]-4,5-dihydro-1,2-oxazole-3-carboxylate

Systemtic Name: methyl (5S)-5-[(2S)-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]-4,5-dihydro-1,2-oxazole-3-carboxylate Openeye Name: methyl (5S)-5-[(2S)-2-(benzyloxycarbonylamino)-3-methoxy-3-oxo-propyl]-4,5-dihydroisoxazole-3-carboxylate CAS Name: (5S)-5-[(2S)-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]-4,5-dihydroisoxazole-3-carboxylic acid methyl ester IUPAC Name: methyl (5S)-5-[(2S)-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]-4,5-dihydro-1,2-oxazole-3-carboxylate Traditional Name: (5S)-5-[(2S)-2-(benzyloxycarbonylamino)-3-keto-3-methoxy-propyl]-2-isoxazoline-3-carboxylic acid methyl ester Formula: C17H20N2O7 MolecularWeight: 364.3499

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NOC(C1)CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=NO[C@H](C1)C[C@@H](C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O7/c1-23-15(20)13(8-12-9-14(19-26-12)16(21)24-2)18-17(22)25-10-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3,(H,18,22)/t12-,13-/m0/s1