ditert-butyl 3-(9-tert-butylperoxy-9-oxidanylidene-nonyl)-6-pentyl-cyclohexane-1,2-dicarboperoxoate

Systemtic Name: ditert-butyl 3-(9-tert-butylperoxy-9-oxidanylidene-nonyl)-6-pentyl-cyclohexane-1,2-dicarboperoxoate Openeye Name: ditert-butyl 3-(9-tert-butylperoxy-9-oxo-nonyl)-6-pentyl-cyclohexane-1,2-dicarboperoxoate CAS Name: 3-(9-tert-butyldioxy-9-oxononyl)-6-pentylcyclohexane-1,2-dicarboperoxoic acid ditert-butyl ester IUPAC Name: ditert-butyl 3-(9-tert-butylperoxy-9-oxononyl)-6-pentylcyclohexane-1,2-dicarboperoxoate Traditional Name: 3-amyl-6-(9-tert-butylperoxy-9-keto-nonyl)cyclohexane-1,2-dicarboperoxoic acid ditert-butyl ester Formula: C34H62O9 MolecularWeight: 614.85068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(C(C1C(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C)CCCCCCCCC(=O)OOC(C)(C)C

Isomeric SMILES

CCCCCC1CCC(C(C1C(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C)CCCCCCCCC(=O)OOC(C)(C)C

InChI

InChI=1S/C34H62O9/c1-11-12-17-20-25-23-24-26(21-18-15-13-14-16-19-22-27(35)38-41-32(2,3)4)29(31(37)40-43-34(8,9)10)28(25)30(36)39-42-33(5,6)7/h25-26,28-29H,11-24H2,1-10H3