[(3Z)-6,7-bis(oxidanyl)-5-oxidanylidene-cyclooct-3-en-1-yl] benzoate

Systemtic Name: [(3Z)-6,7-bis(oxidanyl)-5-oxidanylidene-cyclooct-3-en-1-yl] benzoate Openeye Name: [(3Z)-6,7-dihydroxy-5-oxo-cyclooct-3-en-1-yl] benzoate CAS Name: benzoic acid [(3Z)-6,7-dihydroxy-5-oxo-1-cyclooct-3-enyl] ester IUPAC Name: [(3Z)-6,7-dihydroxy-5-oxocyclooct-3-en-1-yl] benzoate Traditional Name: benzoic acid [(3Z)-6,7-dihydroxy-5-keto-cyclooct-3-en-1-yl] ester Formula: C15H16O5 MolecularWeight: 276.28454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=O)C(C(CC1OC(=O)C2=CC=CC=C2)O)O

Isomeric SMILES

C1/C=C\C(=O)C(C(CC1OC(=O)C2=CC=CC=C2)O)O

InChI

InChI=1S/C15H16O5/c16-12-8-4-7-11(9-13(17)14(12)18)20-15(19)10-5-2-1-3-6-10/h1-6,8,11,13-14,17-18H,7,9H2/b8-4-