1-cyclobutyl-1-oxidanyl-1-phenyl-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-2-one dihydrochloride

Systemtic Name: 1-cyclobutyl-1-oxidanyl-1-phenyl-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-2-one dihydrochloride Openeye Name: 3-[4-[(E)-cinnamyl]piperazin-1-yl]-1-cyclobutyl-1-hydroxy-1-phenyl-propan-2-one dihydrochloride CAS Name: 1-cyclobutyl-1-hydroxy-1-phenyl-3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-2-propanone dihydrochloride IUPAC Name: 1-cyclobutyl-1-hydroxy-1-phenyl-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-2-one dihydrochloride Traditional Name: 3-[4-[(E)-cinnamyl]piperazino]-1-cyclobutyl-1-hydroxy-1-phenyl-acetone dihydrochloride Formula: C26H34Cl2N2O2 MolecularWeight: 477.46636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)CC=CC4=CC=CC=C4)O.Cl.Cl

Isomeric SMILES

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)C/C=C/C4=CC=CC=C4)O.Cl.Cl

InChI

InChI=1S/C26H32N2O2.2ClH/c29-25(26(30,24-14-7-15-24)23-12-5-2-6-13-23)21-28-19-17-27(18-20-28)16-8-11-22-9-3-1-4-10-22;;/h1-6,8-13,24,30H,7,14-21H2;2*1H/b11-8+;;