(phenylmethyl) (2S,3S)-2-(hydroxymethyl)-5-(3-hydroxyphenyl)-3-oxidanyl-pentanoate

Systemtic Name: (phenylmethyl) (2S,3S)-2-(hydroxymethyl)-5-(3-hydroxyphenyl)-3-oxidanyl-pentanoate Openeye Name: benzyl (2S,3S)-3-hydroxy-2-(hydroxymethyl)-5-(3-hydroxyphenyl)pentanoate CAS Name: (2S,3S)-3-hydroxy-2-(hydroxymethyl)-5-(3-hydroxyphenyl)pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S)-3-hydroxy-2-(hydroxymethyl)-5-(3-hydroxyphenyl)pentanoate Traditional Name: (2S,3S)-3-hydroxy-5-(3-hydroxyphenyl)-2-methylol-valeric acid benzyl ester Formula: C19H22O5 MolecularWeight: 330.37498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CO)C(CCC2=CC(=CC=C2)O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)[C@@H](CO)[C@H](CCC2=CC(=CC=C2)O)O

InChI

InChI=1S/C19H22O5/c20-12-17(19(23)24-13-15-5-2-1-3-6-15)18(22)10-9-14-7-4-8-16(21)11-14/h1-8,11,17-18,20-22H,9-10,12-13H2/t17-,18-/m0/s1