[9-acetyloxy-4,6,8-trimethyl-3,7-bis(oxidanylidene)undecan-5-yl] 2-methyl-3-oxidanylidene-pentanoate

Systemtic Name: [9-acetyloxy-4,6,8-trimethyl-3,7-bis(oxidanylidene)undecan-5-yl] 2-methyl-3-oxidanylidene-pentanoate Openeye Name: [5-acetoxy-2,4-dimethyl-1-(1-methyl-2-oxo-butyl)-3-oxo-heptyl] 2-methyl-3-oxo-pentanoate CAS Name: 2-methyl-3-oxopentanoic acid (9-acetyloxy-4,6,8-trimethyl-3,7-dioxoundecan-5-yl) ester IUPAC Name: (9-acetyloxy-4,6,8-trimethyl-3,7-dioxoundecan-5-yl) 2-methyl-3-oxopentanoate Traditional Name: 3-keto-2-methyl-valeric acid [5-acetoxy-3-keto-1-(2-keto-1-methyl-butyl)-2,4-dimethyl-heptyl] ester Formula: C22H36O7 MolecularWeight: 412.51704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36O7/c1-9-17(24)12(4)21(29-22(27)13(5)18(25)10-2)15(7)20(26)14(6)19(11-3)28-16(8)23/h12-15,19,21H,9-11H2,1-8H3