[4-[2,2-bis(4-acetyloxy-3-oxidanyl-cyclohexyl)ethyl]-2-oxidanyl-cyclohexyl] ethanoate

Systemtic Name: [4-[2,2-bis(4-acetyloxy-3-oxidanyl-cyclohexyl)ethyl]-2-oxidanyl-cyclohexyl] ethanoate Openeye Name: [4-[2,2-bis(4-acetoxy-3-hydroxy-cyclohexyl)ethyl]-2-hydroxy-cyclohexyl] acetate CAS Name: acetic acid [4-[2,2-bis(4-acetyloxy-3-hydroxycyclohexyl)ethyl]-2-hydroxycyclohexyl] ester IUPAC Name: [4-[2,2-bis(4-acetyloxy-3-hydroxycyclohexyl)ethyl]-2-hydroxycyclohexyl] acetate Traditional Name: acetic acid [4-[2,2-bis(4-acetoxy-3-hydroxy-cyclohexyl)ethyl]-2-hydroxy-cyclohexyl] ester Formula: C26H42O9 MolecularWeight: 498.60628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC(CC1O)CC(C2CCC(C(C2)O)OC(=O)C)C3CCC(C(C3)O)OC(=O)C

Isomeric SMILES

CC(=O)OC1CCC(CC1O)CC(C2CCC(C(C2)O)OC(=O)C)C3CCC(C(C3)O)OC(=O)C

InChI

InChI=1S/C26H42O9/c1-14(27)33-24-7-4-17(11-21(24)30)10-20(18-5-8-25(22(31)12-18)34-15(2)28)19-6-9-26(23(32)13-19)35-16(3)29/h17-26,30-32H,4-13H2,1-3H3