methyl (2S,3S)-3-(4-cyanophenyl)-2-[(4-methoxyphenyl)methoxy]-3-oxidanyl-2-phenyl-propanoate

Systemtic Name: methyl (2S,3S)-3-(4-cyanophenyl)-2-[(4-methoxyphenyl)methoxy]-3-oxidanyl-2-phenyl-propanoate Openeye Name: methyl (2S,3S)-3-(4-cyanophenyl)-3-hydroxy-2-[(4-methoxyphenyl)methoxy]-2-phenyl-propanoate CAS Name: (2S,3S)-3-(4-cyanophenyl)-3-hydroxy-2-[(4-methoxyphenyl)methoxy]-2-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-(4-cyanophenyl)-3-hydroxy-2-[(4-methoxyphenyl)methoxy]-2-phenylpropanoate Traditional Name: (2S,3S)-3-(4-cyanophenyl)-3-hydroxy-2-p-anisyloxy-2-phenyl-propionic acid methyl ester Formula: C25H23NO5 MolecularWeight: 417.45382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(C2=CC=CC=C2)(C(C3=CC=C(C=C3)C#N)O)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CO[C@@](C2=CC=CC=C2)([C@H](C3=CC=C(C=C3)C#N)O)C(=O)OC

InChI

InChI=1S/C25H23NO5/c1-29-22-14-10-19(11-15-22)17-31-25(24(28)30-2,21-6-4-3-5-7-21)23(27)20-12-8-18(16-26)9-13-20/h3-15,23,27H,17H2,1-2H3/t23-,25-/m0/s1