[2,7-dimethyl-7-(2-phenylbutanoylperoxy)octan-2-yl] 2-phenylbutaneperoxoate

Systemtic Name: [2,7-dimethyl-7-(2-phenylbutanoylperoxy)octan-2-yl] 2-phenylbutaneperoxoate Openeye Name: [1,1,6-trimethyl-6-(2-phenylbutanoylperoxy)heptyl] 2-phenylbutaneperoxoate CAS Name: 2-phenylbutaneperoxoic acid [2,7-dimethyl-7-(1-oxo-2-phenylbutyl)dioxyoctan-2-yl] ester IUPAC Name: [2,7-dimethyl-7-(2-phenylbutanoylperoxy)octan-2-yl] 2-phenylbutaneperoxoate Traditional Name: 2-phenylperoxybutyric acid [1,1,6-trimethyl-6-(2-phenylbutanoylperoxy)heptyl] ester Formula: C30H42O6 MolecularWeight: 498.65088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OOC(C)(C)CCCCC(C)(C)OOC(=O)C(CC)C2=CC=CC=C2

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OOC(C)(C)CCCCC(C)(C)OOC(=O)C(CC)C2=CC=CC=C2

InChI

InChI=1S/C30H42O6/c1-7-25(23-17-11-9-12-18-23)27(31)33-35-29(3,4)21-15-16-22-30(5,6)36-34-28(32)26(8-2)24-19-13-10-14-20-24/h9-14,17-20,25-26H,7-8,15-16,21-22H2,1-6H3