dibutyl 4-[3,4-bis(butylperoxycarbonyl)phenyl]carbonylbenzene-1,2-dicarboperoxoate

Systemtic Name: dibutyl 4-[3,4-bis(butylperoxycarbonyl)phenyl]carbonylbenzene-1,2-dicarboperoxoate Openeye Name: dibutyl 4-[3,4-bis(butylperoxycarbonyl)benzoyl]benzene-1,2-dicarboperoxoate CAS Name: 4-[[3,4-bis[butyldioxy(oxo)methyl]phenyl]-oxomethyl]benzene-1,2-dicarboperoxoic acid dibutyl ester IUPAC Name: dibutyl 4-[3,4-bis(butylperoxycarbonyl)benzoyl]benzene-1,2-dicarboperoxoate Traditional Name: 4-[3,4-bis(butylperoxycarbonyl)benzoyl]benzene-1,2-dicarboperoxoic acid dibutyl ester Formula: C33H42O13 MolecularWeight: 646.67878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOOC(=O)C1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)C(=O)OOCCCC)C(=O)OOCCCC)C(=O)OOCCCC

Isomeric SMILES

CCCCOOC(=O)C1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)C(=O)OOCCCC)C(=O)OOCCCC)C(=O)OOCCCC

InChI

InChI=1S/C33H42O13/c1-5-9-17-39-43-30(35)25-15-13-23(21-27(25)32(37)45-41-19-11-7-3)29(34)24-14-16-26(31(36)44-40-18-10-6-2)28(22-24)33(38)46-42-20-12-8-4/h13-16,21-22H,5-12,17-20H2,1-4H3