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

Systemtic Name: 3-[4-[2-(3-methylbutoxy)-2-phenyl-ethyl]piperazin-1-yl]-1-phenyl-propan-1-one dihydrochloride Openeye Name: 3-[4-(2-isopentyloxy-2-phenyl-ethyl)piperazin-1-yl]-1-phenyl-propan-1-one dihydrochloride CAS Name: 3-[4-[2-(3-methylbutoxy)-2-phenylethyl]-1-piperazinyl]-1-phenyl-1-propanone dihydrochloride IUPAC Name: 3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]-1-phenylpropan-1-one dihydrochloride Traditional Name: 3-[4-(2-isoamoxy-2-phenyl-ethyl)piperazino]-1-phenyl-propan-1-one dihydrochloride Formula: C26H38Cl2N2O2 MolecularWeight: 481.49812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(CN1CCN(CC1)CCC(=O)C2=CC=CC=C2)C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CC(C)CCOC(CN1CCN(CC1)CCC(=O)C2=CC=CC=C2)C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C26H36N2O2.2ClH/c1-22(2)14-20-30-26(24-11-7-4-8-12-24)21-28-18-16-27(17-19-28)15-13-25(29)23-9-5-3-6-10-23;;/h3-12,22,26H,13-21H2,1-2H3;2*1H