6-tert-butylperoxycarbonyl-2-(9-tert-butylperoxy-9-oxidanylidene-nonyl)-5-pentyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-tert-butylperoxycarbonyl-2-(9-tert-butylperoxy-9-oxidanylidene-nonyl)-5-pentyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-tert-butylperoxycarbonyl-2-(9-tert-butylperoxy-9-oxo-nonyl)-5-pentyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[tert-butyldioxy(oxo)methyl]-2-(9-tert-butyldioxy-9-oxononyl)-5-pentyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-tert-butylperoxycarbonyl-2-(9-tert-butylperoxy-9-oxononyl)-5-pentylcyclohex-3-ene-1-carboxylic acid Traditional Name: 5-amyl-6-tert-butylperoxycarbonyl-2-(9-tert-butylperoxy-9-keto-nonyl)cyclohex-3-ene-1-carboxylic acid Formula: C30H52O8 MolecularWeight: 540.72908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C=CC(C(C1C(=O)OOC(C)(C)C)C(=O)O)CCCCCCCCC(=O)OOC(C)(C)C

Isomeric SMILES

CCCCCC1C=CC(C(C1C(=O)OOC(C)(C)C)C(=O)O)CCCCCCCCC(=O)OOC(C)(C)C

InChI

InChI=1S/C30H52O8/c1-8-9-14-17-23-21-20-22(25(27(32)33)26(23)28(34)36-38-30(5,6)7)18-15-12-10-11-13-16-19-24(31)35-37-29(2,3)4/h20-23,25-26H,8-19H2,1-7H3,(H,32,33)