1,2,4,5,6-pentakis(oxidanyl)hexan-3-yl benzoate

Systemtic Name: 1,2,4,5,6-pentakis(oxidanyl)hexan-3-yl benzoate Openeye Name: [1-(1,2-dihydroxyethyl)-2,3,4-trihydroxy-butyl] benzoate CAS Name: benzoic acid 1,2,4,5,6-pentahydroxyhexan-3-yl ester IUPAC Name: 1,2,4,5,6-pentahydroxyhexan-3-yl benzoate Traditional Name: benzoic acid [1-(1,2-dihydroxyethyl)-2,3,4-trihydroxy-butyl] ester Formula: C13H18O7 MolecularWeight: 286.27782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(C(CO)O)C(C(CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC(C(CO)O)C(C(CO)O)O

InChI

InChI=1S/C13H18O7/c14-6-9(16)11(18)12(10(17)7-15)20-13(19)8-4-2-1-3-5-8/h1-5,9-12,14-18H,6-7H2