2-[2,10-dimethyl-5-oxidanyl-3,9-bis(oxidanylidene)undeca-1,10-dien-6-yl]oxycarbonylcyclohexane-1-carboxylic acid

Systemtic Name: 2-[2,10-dimethyl-5-oxidanyl-3,9-bis(oxidanylidene)undeca-1,10-dien-6-yl]oxycarbonylcyclohexane-1-carboxylic acid Openeye Name: 2-[2-hydroxy-5-methyl-1-(4-methyl-3-oxo-pent-4-enyl)-4-oxo-hex-5-enoxy]carbonylcyclohexanecarboxylic acid CAS Name: 2-[(5-hydroxy-2,10-dimethyl-3,9-dioxoundeca-1,10-dien-6-yl)oxy-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-(5-hydroxy-2,10-dimethyl-3,9-dioxoundeca-1,10-dien-6-yl)oxycarbonylcyclohexane-1-carboxylic acid Traditional Name: 2-[2-hydroxy-4-keto-1-(3-keto-4-methyl-pent-4-enyl)-5-methyl-hex-5-enoxy]carbonylcyclohexanecarboxylic acid Formula: C21H30O7 MolecularWeight: 394.4587

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)CCC(C(CC(=O)C(=C)C)O)OC(=O)C1CCCCC1C(=O)O

Isomeric SMILES

CC(=C)C(=O)CCC(C(CC(=O)C(=C)C)O)OC(=O)C1CCCCC1C(=O)O

InChI

InChI=1S/C21H30O7/c1-12(2)16(22)9-10-19(18(24)11-17(23)13(3)4)28-21(27)15-8-6-5-7-14(15)20(25)26/h14-15,18-19,24H,1,3,5-11H2,2,4H3,(H,25,26)