methyl (2S)-2-oxidanyl-3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: methyl (2S)-2-oxidanyl-3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: methyl (2S)-2-hydroxy-3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: (2S)-2-hydroxy-3-(3,4,5-trimethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-hydroxy-3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: (2S)-2-hydroxy-3-(3,4,5-trimethoxyphenyl)propionic acid methyl ester Formula: C13H18O6 MolecularWeight: 270.27842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(C(=O)OC)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C[C@@H](C(=O)OC)O

InChI

InChI=1S/C13H18O6/c1-16-10-6-8(5-9(14)13(15)19-4)7-11(17-2)12(10)18-3/h6-7,9,14H,5H2,1-4H3/t9-/m0/s1