(2S,3R)-5-methoxy-3-methoxycarbonyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S,3R)-5-methoxy-3-methoxycarbonyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S,3R)-2-(benzyloxycarbonylamino)-5-methoxy-3-methoxycarbonyl-5-oxo-pentanoic acid CAS Name: (2S,3R)-5-methoxy-3-methoxycarbonyl-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S,3R)-5-methoxy-3-methoxycarbonyl-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-carbomethoxy-5-keto-5-methoxy-valeric acid Formula: C16H19NO8 MolecularWeight: 353.32396

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(C(=O)O)NC(=O)OCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C[C@H]([C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C16H19NO8/c1-23-12(18)8-11(15(21)24-2)13(14(19)20)17-16(22)25-9-10-6-4-3-5-7-10/h3-7,11,13H,8-9H2,1-2H3,(H,17,22)(H,19,20)/t11-,13+/m1/s1