2-methylpropanoyl 5-(8-ethanoylperoxy-8-oxidanylidene-octyl)-2-hexyl-cyclohex-3-ene-1-carboperoxoate

Systemtic Name: 2-methylpropanoyl 5-(8-ethanoylperoxy-8-oxidanylidene-octyl)-2-hexyl-cyclohex-3-ene-1-carboperoxoate Openeye Name: 2-methylpropanoyl 5-(8-acetylperoxy-8-oxo-octyl)-2-hexyl-cyclohex-3-ene-1-carboperoxoate CAS Name: 5-(8-acetyldioxy-8-oxooctyl)-2-hexyl-1-cyclohex-3-enecarboperoxoic acid (2-methyl-1-oxopropyl) ester IUPAC Name: 2-methylpropanoyl 5-(8-acetylperoxy-8-oxooctyl)-2-hexylcyclohex-3-ene-1-carboperoxoate Traditional Name: 5-(8-acetylperoxy-8-keto-octyl)-2-hexyl-cyclohex-3-ene-1-carboperoxoic acid isobutyryl ester Formula: C27H44O8 MolecularWeight: 496.63346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C=CC(CC1C(=O)OOC(=O)C(C)C)CCCCCCCC(=O)OOC(=O)C

Isomeric SMILES

CCCCCCC1C=CC(CC1C(=O)OOC(=O)C(C)C)CCCCCCCC(=O)OOC(=O)C

InChI

InChI=1S/C27H44O8/c1-5-6-7-12-15-23-18-17-22(19-24(23)27(31)35-34-26(30)20(2)3)14-11-9-8-10-13-16-25(29)33-32-21(4)28/h17-18,20,22-24H,5-16,19H2,1-4H3