cyclohexyl 3-[4-methyl-3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]-2-phenyl-propaneperoxoate

Systemtic Name: cyclohexyl 3-[4-methyl-3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]-2-phenyl-propaneperoxoate Openeye Name: cyclohexyl 3-(3-benzyl-4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-phenyl-propaneperoxoate CAS Name: 3-[4-methyl-3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]-2-phenylpropaneperoxoic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-(3-benzyl-4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-phenylpropaneperoxoate Traditional Name: 3-(3-benzyl-4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-phenyl-peroxypropionic acid cyclohexyl ester Formula: C28H35NO3 MolecularWeight: 433.5824

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C2CC(C3=CC=CC=C3)C(=O)OOC4CCCCC4)CN1CC5=CC=CC=C5

Isomeric SMILES

CC1C2C(C2CC(C3=CC=CC=C3)C(=O)OOC4CCCCC4)CN1CC5=CC=CC=C5

InChI

InChI=1S/C28H35NO3/c1-20-27-25(26(27)19-29(20)18-21-11-5-2-6-12-21)17-24(22-13-7-3-8-14-22)28(30)32-31-23-15-9-4-10-16-23/h2-3,5-8,11-14,20,23-27H,4,9-10,15-19H2,1H3