tert-butyl 2-(9-tert-butylperoxy-9-oxidanylidene-nonyl)-5-pentyl-cyclohex-3-ene-1-carboperoxoate

Systemtic Name: tert-butyl 2-(9-tert-butylperoxy-9-oxidanylidene-nonyl)-5-pentyl-cyclohex-3-ene-1-carboperoxoate Openeye Name: tert-butyl 2-(9-tert-butylperoxy-9-oxo-nonyl)-5-pentyl-cyclohex-3-ene-1-carboperoxoate CAS Name: 2-(9-tert-butyldioxy-9-oxononyl)-5-pentyl-1-cyclohex-3-enecarboperoxoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(9-tert-butylperoxy-9-oxononyl)-5-pentylcyclohex-3-ene-1-carboperoxoate Traditional Name: 5-amyl-2-(9-tert-butylperoxy-9-keto-nonyl)cyclohex-3-ene-1-carboperoxoic acid tert-butyl ester Formula: C29H52O6 MolecularWeight: 496.71958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H52O6/c1-8-9-14-17-23-20-21-24(25(22-23)27(31)33-35-29(5,6)7)18-15-12-10-11-13-16-19-26(30)32-34-28(2,3)4/h20-21,23-25H,8-19,22H2,1-7H3