3-[1,11-bis(oxidanyl)-9-oxidanylidene-dodecyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[1,11-bis(oxidanyl)-9-oxidanylidene-dodecyl]-4-methoxy-benzoic acid Openeye Name: 3-(1,11-dihydroxy-9-oxo-dodecyl)-4-methoxy-benzoic acid CAS Name: 3-(1,11-dihydroxy-9-oxododecyl)-4-methoxybenzoic acid IUPAC Name: 3-(1,11-dihydroxy-9-oxododecyl)-4-methoxybenzoic acid Traditional Name: 3-(1,11-dihydroxy-9-keto-dodecyl)-4-methoxy-benzoic acid Formula: C20H30O6 MolecularWeight: 366.4486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30O6/c1-14(21)12-16(22)8-6-4-3-5-7-9-18(23)17-13-15(20(24)25)10-11-19(17)26-2/h10-11,13-14,18,21,23H,3-9,12H2,1-2H3,(H,24,25)