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

Systemtic Name: 1-(4-bromophenyl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one dihydrochloride Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-(4-bromophenyl)propan-1-one dihydrochloride CAS Name: 1-(4-bromophenyl)-3-[4-(phenylmethyl)-1-piperazinyl]-1-propanone dihydrochloride IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-(4-bromophenyl)propan-1-one dihydrochloride Traditional Name: 3-(4-benzylpiperazino)-1-(4-bromophenyl)propan-1-one dihydrochloride Formula: C20H25BrCl2N2O MolecularWeight: 460.2353

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)C2=CC=C(C=C2)Br)CC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)C2=CC=C(C=C2)Br)CC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C20H23BrN2O.2ClH/c21-19-8-6-18(7-9-19)20(24)10-11-22-12-14-23(15-13-22)16-17-4-2-1-3-5-17;;/h1-9H,10-16H2;2*1H