phenyl 2-[(4-cyclohexylpiperazin-1-yl)methyl]-2,3-dimethoxy-butaneperoxoate

Systemtic Name: phenyl 2-[(4-cyclohexylpiperazin-1-yl)methyl]-2,3-dimethoxy-butaneperoxoate Openeye Name: phenyl 2-[(4-cyclohexylpiperazin-1-yl)methyl]-2,3-dimethoxy-butaneperoxoate CAS Name: 2-[(4-cyclohexyl-1-piperazinyl)methyl]-2,3-dimethoxybutaneperoxoic acid phenyl ester IUPAC Name: phenyl 2-[(4-cyclohexylpiperazin-1-yl)methyl]-2,3-dimethoxybutaneperoxoate Traditional Name: 2-[(4-cyclohexylpiperazino)methyl]-2,3-dimethoxy-peroxybutyric acid phenyl ester Formula: C23H36N2O5 MolecularWeight: 420.54234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1CCN(CC1)C2CCCCC2)(C(=O)OOC3=CC=CC=C3)OC)OC

Isomeric SMILES

CC(C(CN1CCN(CC1)C2CCCCC2)(C(=O)OOC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C23H36N2O5/c1-19(27-2)23(28-3,22(26)30-29-21-12-8-5-9-13-21)18-24-14-16-25(17-15-24)20-10-6-4-7-11-20/h5,8-9,12-13,19-20H,4,6-7,10-11,14-18H2,1-3H3