2,4,4-trimethylpentan-2-yl 2-[9-oxidanylidene-9-(2,4,4-trimethylpentan-2-ylperoxy)nonyl]-5-pentyl-cyclohex-3-ene-1-carboperoxoate

Systemtic Name: 2,4,4-trimethylpentan-2-yl 2-[9-oxidanylidene-9-(2,4,4-trimethylpentan-2-ylperoxy)nonyl]-5-pentyl-cyclohex-3-ene-1-carboperoxoate Openeye Name: 1,1,3,3-tetramethylbutyl 2-[9-oxo-9-(1,1,3,3-tetramethylbutylperoxy)nonyl]-5-pentyl-cyclohex-3-ene-1-carboperoxoate CAS Name: 2-[9-oxo-9-(2,4,4-trimethylpentan-2-yldioxy)nonyl]-5-pentyl-1-cyclohex-3-enecarboperoxoic acid 2,4,4-trimethylpentan-2-yl ester IUPAC Name: 2,4,4-trimethylpentan-2-yl 2-[9-oxo-9-(2,4,4-trimethylpentan-2-ylperoxy)nonyl]-5-pentylcyclohex-3-ene-1-carboperoxoate Traditional Name: 5-amyl-2-[9-keto-9-(1,1,3,3-tetramethylbutylperoxy)nonyl]cyclohex-3-ene-1-carboperoxoic acid 1,1,3,3-tetramethylbutyl ester Formula: C37H68O6 MolecularWeight: 608.93222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(C(C=C1)CCCCCCCCC(=O)OOC(C)(C)CC(C)(C)C)C(=O)OOC(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCCC1CC(C(C=C1)CCCCCCCCC(=O)OOC(C)(C)CC(C)(C)C)C(=O)OOC(C)(C)CC(C)(C)C

InChI

InChI=1S/C37H68O6/c1-12-13-18-21-29-24-25-30(31(26-29)33(39)41-43-37(10,11)28-35(5,6)7)22-19-16-14-15-17-20-23-32(38)40-42-36(8,9)27-34(2,3)4/h24-25,29-31H,12-23,26-28H2,1-11H3