1-(diphenylmethyl)-4-[[3-methyl-4-(4-methylphenyl)pyridin-2-yl]methyl]piperazine dihydrochloride

Systemtic Name: 1-(diphenylmethyl)-4-[[3-methyl-4-(4-methylphenyl)pyridin-2-yl]methyl]piperazine dihydrochloride Openeye Name: 1-benzhydryl-4-[[3-methyl-4-(p-tolyl)-2-pyridyl]methyl]piperazine dihydrochloride CAS Name: 1-(diphenylmethyl)-4-[[3-methyl-4-(4-methylphenyl)-2-pyridinyl]methyl]piperazine dihydrochloride IUPAC Name: 1-benzhydryl-4-[[3-methyl-4-(4-methylphenyl)pyridin-2-yl]methyl]piperazine dihydrochloride Traditional Name: 1-benzhydryl-4-[[3-methyl-4-(p-tolyl)-2-pyridyl]methyl]piperazine dihydrochloride Formula: C31H35Cl2N3 MolecularWeight: 520.5357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC=C2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C.Cl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC=C2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C.Cl.Cl

InChI

InChI=1S/C31H33N3.2ClH/c1-24-13-15-26(16-14-24)29-17-18-32-30(25(29)2)23-33-19-21-34(22-20-33)31(27-9-5-3-6-10-27)28-11-7-4-8-12-28;;/h3-18,31H,19-23H2,1-2H3;2*1H