[1,2,3,4-tetrakis(oxidanyl)-5-oxidanylidene-cyclohexyl]methyl benzoate

Systemtic Name: [1,2,3,4-tetrakis(oxidanyl)-5-oxidanylidene-cyclohexyl]methyl benzoate Openeye Name: (1,2,3,4-tetrahydroxy-5-oxo-cyclohexyl)methyl benzoate CAS Name: benzoic acid (1,2,3,4-tetrahydroxy-5-oxocyclohexyl)methyl ester IUPAC Name: (1,2,3,4-tetrahydroxy-5-oxocyclohexyl)methyl benzoate Traditional Name: benzoic acid (1,2,3,4-tetrahydroxy-5-keto-cyclohexyl)methyl ester Formula: C14H16O7 MolecularWeight: 296.27264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(C(C(C1(COC(=O)C2=CC=CC=C2)O)O)O)O

Isomeric SMILES

C1C(=O)C(C(C(C1(COC(=O)C2=CC=CC=C2)O)O)O)O

InChI

InChI=1S/C14H16O7/c15-9-6-14(20,12(18)11(17)10(9)16)7-21-13(19)8-4-2-1-3-5-8/h1-5,10-12,16-18,20H,6-7H2