methyl (2S,3R)-3-(3-acetyloxy-4-phenylmethoxy-phenyl)-2-(methylamino)-3-oxidanyl-propanoate

Systemtic Name: methyl (2S,3R)-3-(3-acetyloxy-4-phenylmethoxy-phenyl)-2-(methylamino)-3-oxidanyl-propanoate Openeye Name: methyl (2S,3R)-3-(3-acetoxy-4-benzyloxy-phenyl)-3-hydroxy-2-(methylamino)propanoate CAS Name: (2S,3R)-3-(3-acetyloxy-4-phenylmethoxyphenyl)-3-hydroxy-2-(methylamino)propanoic acid methyl ester IUPAC Name: methyl (2S,3R)-3-(3-acetyloxy-4-phenylmethoxyphenyl)-3-hydroxy-2-(methylamino)propanoate Traditional Name: (2S,3R)-3-(3-acetoxy-4-benzoxy-phenyl)-3-hydroxy-2-(methylamino)propionic acid methyl ester Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1)C(C(C(=O)OC)NC)O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1)[C@H]([C@@H](C(=O)OC)NC)O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23NO6/c1-13(22)27-17-11-15(19(23)18(21-2)20(24)25-3)9-10-16(17)26-12-14-7-5-4-6-8-14/h4-11,18-19,21,23H,12H2,1-3H3/t18-,19+/m0/s1