(phenylmethyl) (2S,3S,4R)-2-acetamido-5-methoxy-4-oxidanyl-3-phenylmethoxy-pentanoate

Systemtic Name: (phenylmethyl) (2S,3S,4R)-2-acetamido-5-methoxy-4-oxidanyl-3-phenylmethoxy-pentanoate Openeye Name: benzyl (2S,3S,4R)-2-acetamido-3-benzyloxy-4-hydroxy-5-methoxy-pentanoate CAS Name: (2S,3S,4R)-2-acetamido-4-hydroxy-5-methoxy-3-phenylmethoxypentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S,4R)-2-acetamido-4-hydroxy-5-methoxy-3-phenylmethoxypentanoate Traditional Name: (2S,3S,4R)-2-acetamido-3-benzoxy-4-hydroxy-5-methoxy-valeric acid benzyl ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(C(COC)O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@@H]([C@@H]([C@@H](COC)O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27NO6/c1-16(24)23-20(22(26)29-14-18-11-7-4-8-12-18)21(19(25)15-27-2)28-13-17-9-5-3-6-10-17/h3-12,19-21,25H,13-15H2,1-2H3,(H,23,24)/t19-,20+,21-/m1/s1