methyl (2S,3R)-3-(3-acetyloxy-4-phenylmethoxy-phenyl)-2-[(4-methoxyphenyl)methyl-methyl-amino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S,3R)-3-(3-acetyloxy-4-phenylmethoxy-phenyl)-2-[(4-methoxyphenyl)methyl-methyl-amino]-3-oxidanyl-propanoate Openeye Name: methyl (2S,3R)-3-(3-acetoxy-4-benzyloxy-phenyl)-3-hydroxy-2-[(4-methoxyphenyl)methyl-methyl-amino]propanoate CAS Name: (2S,3R)-3-(3-acetyloxy-4-phenylmethoxyphenyl)-3-hydroxy-2-[(4-methoxyphenyl)methyl-methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S,3R)-3-(3-acetyloxy-4-phenylmethoxyphenyl)-3-hydroxy-2-[(4-methoxyphenyl)methyl-methylamino]propanoate Traditional Name: (2S,3R)-3-(3-acetoxy-4-benzoxy-phenyl)-3-hydroxy-2-[methyl(p-anisyl)amino]propionic acid methyl ester Formula: C28H31NO7 MolecularWeight: 493.54824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1)C(C(C(=O)OC)N(C)CC2=CC=C(C=C2)OC)O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1)[C@H]([C@@H](C(=O)OC)N(C)CC2=CC=C(C=C2)OC)O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H31NO7/c1-19(30)36-25-16-22(12-15-24(25)35-18-21-8-6-5-7-9-21)27(31)26(28(32)34-4)29(2)17-20-10-13-23(33-3)14-11-20/h5-16,26-27,31H,17-18H2,1-4H3/t26-,27+/m0/s1