(2S,3R)-3-methoxycarbonyl-2-(phenylmethoxycarbonylamino)hex-5-enoic acid

Systemtic Name: (2S,3R)-3-methoxycarbonyl-2-(phenylmethoxycarbonylamino)hex-5-enoic acid Openeye Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-methoxycarbonyl-hex-5-enoic acid CAS Name: (2S,3R)-3-methoxycarbonyl-2-(phenylmethoxycarbonylamino)-5-hexenoic acid IUPAC Name: (2S,3R)-3-methoxycarbonyl-2-(phenylmethoxycarbonylamino)hex-5-enoic acid Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-carbomethoxy-hex-5-enoic acid Formula: C16H19NO6 MolecularWeight: 321.32516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO6/c1-3-7-12(15(20)22-2)13(14(18)19)17-16(21)23-10-11-8-5-4-6-9-11/h3-6,8-9,12-13H,1,7,10H2,2H3,(H,17,21)(H,18,19)/t12-,13+/m1/s1