2-phenylpropan-2-yl 4,4-dimethylpentaneperoxoate

Systemtic Name: 2-phenylpropan-2-yl 4,4-dimethylpentaneperoxoate Openeye Name: (1-methyl-1-phenyl-ethyl) 4,4-dimethylpentaneperoxoate CAS Name: 4,4-dimethylpentaneperoxoic acid 2-phenylpropan-2-yl ester IUPAC Name: 2-phenylpropan-2-yl 4,4-dimethylpentaneperoxoate Traditional Name: 4,4-dimethylperoxyvaleric acid cumyl ester Formula: C16H24O3 MolecularWeight: 264.35996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O3/c1-15(2,3)12-11-14(17)18-19-16(4,5)13-9-7-6-8-10-13/h6-10H,11-12H2,1-5H3