tetratert-butyl 4-(phenylcarbonyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboperoxoate

Systemtic Name: tetratert-butyl 4-(phenylcarbonyl)cyclohexa-3,5-diene-1,1,2,2-tetracarboperoxoate Openeye Name: tetratert-butyl 4-benzoylcyclohexa-3,5-diene-1,1,2,2-tetracarboperoxoate CAS Name: 4-benzoylcyclohexa-3,5-diene-1,1,2,2-tetracarboperoxoic acid tetratert-butyl ester IUPAC Name: tetratert-butyl 4-benzoylcyclohexa-3,5-diene-1,1,2,2-tetracarboperoxoate Traditional Name: 4-benzoylcyclohexa-3,5-diene-1,1,2,2-tetracarboperoxoic acid tetratert-butyl ester Formula: C33H44O13 MolecularWeight: 648.69466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OOC(=O)C1(C=CC(=CC1(C(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C)C(=O)C2=CC=CC=C2)C(=O)OOC(C)(C)C

Isomeric SMILES

CC(C)(C)OOC(=O)C1(C=CC(=CC1(C(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C)C(=O)C2=CC=CC=C2)C(=O)OOC(C)(C)C

InChI

InChI=1S/C33H44O13/c1-28(2,3)43-39-24(35)32(25(36)40-44-29(4,5)6)19-18-22(23(34)21-16-14-13-15-17-21)20-33(32,26(37)41-45-30(7,8)9)27(38)42-46-31(10,11)12/h13-20H,1-12H3