3-[4-(phenylmethyl)piperazin-1-yl]-1-(4-phenylphenyl)propan-1-one dihydrochloride

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]-1-(4-phenylphenyl)propan-1-one dihydrochloride Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-(4-phenylphenyl)propan-1-one dihydrochloride CAS Name: 3-[4-(phenylmethyl)-1-piperazinyl]-1-(4-phenylphenyl)-1-propanone dihydrochloride IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-(4-phenylphenyl)propan-1-one dihydrochloride Traditional Name: 3-(4-benzylpiperazino)-1-(4-phenylphenyl)propan-1-one dihydrochloride Formula: C26H30Cl2N2O MolecularWeight: 457.4352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CC4=CC=CC=C4.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CC4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C26H28N2O.2ClH/c29-26(25-13-11-24(12-14-25)23-9-5-2-6-10-23)15-16-27-17-19-28(20-18-27)21-22-7-3-1-4-8-22;;/h1-14H,15-21H2;2*1H