3-[4-[1-[(2-methylpropan-2-yl)oxy]-2-phenyl-ethyl]piperazin-1-yl]-1-phenyl-propan-1-one dihydrochloride

Systemtic Name: 3-[4-[1-[(2-methylpropan-2-yl)oxy]-2-phenyl-ethyl]piperazin-1-yl]-1-phenyl-propan-1-one dihydrochloride Openeye Name: 3-[4-(1-tert-butoxy-2-phenyl-ethyl)piperazin-1-yl]-1-phenyl-propan-1-one dihydrochloride CAS Name: 3-[4-[1-[(2-methylpropan-2-yl)oxy]-2-phenylethyl]-1-piperazinyl]-1-phenyl-1-propanone dihydrochloride IUPAC Name: 3-[4-[1-[(2-methylpropan-2-yl)oxy]-2-phenylethyl]piperazin-1-yl]-1-phenylpropan-1-one dihydrochloride Traditional Name: 3-[4-(1-tert-butoxy-2-phenyl-ethyl)piperazino]-1-phenyl-propan-1-one dihydrochloride Formula: C25H36Cl2N2O2 MolecularWeight: 467.47154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(CC1=CC=CC=C1)N2CCN(CC2)CCC(=O)C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CC(C)(C)OC(CC1=CC=CC=C1)N2CCN(CC2)CCC(=O)C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C25H34N2O2.2ClH/c1-25(2,3)29-24(20-21-10-6-4-7-11-21)27-18-16-26(17-19-27)15-14-23(28)22-12-8-5-9-13-22;;/h4-13,24H,14-20H2,1-3H3;2*1H