methyl (2S)-2-(acetyloxymethyl)-2-oxidanyl-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-(acetyloxymethyl)-2-oxidanyl-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(acetoxymethyl)-2-hydroxy-3-phenyl-propanoate CAS Name: (2S)-2-(acetyloxymethyl)-2-hydroxy-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(acetyloxymethyl)-2-hydroxy-3-phenylpropanoate Traditional Name: (2S)-2-(acetoxymethyl)-2-hydroxy-3-phenyl-propionic acid methyl ester Formula: C13H16O5 MolecularWeight: 252.26314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC1=CC=CC=C1)(C(=O)OC)O

Isomeric SMILES

CC(=O)OC[C@@](CC1=CC=CC=C1)(C(=O)OC)O

InChI

InChI=1S/C13H16O5/c1-10(14)18-9-13(16,12(15)17-2)8-11-6-4-3-5-7-11/h3-7,16H,8-9H2,1-2H3/t13-/m0/s1