(phenylmethyl) (2S,3R)-3-(4-methylphenyl)sulfonyloxy-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (phenylmethyl) (2S,3R)-3-(4-methylphenyl)sulfonyloxy-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: benzyl (2S,3R)-2-(benzyloxycarbonylamino)-3-(p-tolylsulfonyloxy)butanoate CAS Name: (2S,3R)-3-(4-methylphenyl)sulfonyloxy-2-(phenylmethoxycarbonylamino)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-3-(4-methylphenyl)sulfonyloxy-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-tosyloxy-butyric acid benzyl ester Formula: C26H27NO7S MolecularWeight: 497.56008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H](C)[C@@H](C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H27NO7S/c1-19-13-15-23(16-14-19)35(30,31)34-20(2)24(25(28)32-17-21-9-5-3-6-10-21)27-26(29)33-18-22-11-7-4-8-12-22/h3-16,20,24H,17-18H2,1-2H3,(H,27,29)/t20-,24+/m1/s1