[5-(hydroxymethyl)-3-methyl-3,4-bis(oxidanyl)oxolan-2-yl] benzoate

Systemtic Name: [5-(hydroxymethyl)-3-methyl-3,4-bis(oxidanyl)oxolan-2-yl] benzoate Openeye Name: [3,4-dihydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-yl] benzoate CAS Name: benzoic acid [3,4-dihydroxy-5-(hydroxymethyl)-3-methyl-2-oxolanyl] ester IUPAC Name: [3,4-dihydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl] benzoate Traditional Name: benzoic acid (3,4-dihydroxy-3-methyl-5-methylol-tetrahydrofuran-2-yl) ester Formula: C13H16O6 MolecularWeight: 268.26254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(OC1OC(=O)C2=CC=CC=C2)CO)O)O

Isomeric SMILES

CC1(C(C(OC1OC(=O)C2=CC=CC=C2)CO)O)O

InChI

InChI=1S/C13H16O6/c1-13(17)10(15)9(7-14)18-12(13)19-11(16)8-5-3-2-4-6-8/h2-6,9-10,12,14-15,17H,7H2,1H3