2-[4-[(4-methoxy-3-phenyl-phenyl)methyl]piperazin-1-yl]pyrimidine dihydrochloride

Systemtic Name: 2-[4-[(4-methoxy-3-phenyl-phenyl)methyl]piperazin-1-yl]pyrimidine dihydrochloride Openeye Name: 2-[4-[(4-methoxy-3-phenyl-phenyl)methyl]piperazin-1-yl]pyrimidine dihydrochloride CAS Name: 2-[4-[(4-methoxy-3-phenylphenyl)methyl]-1-piperazinyl]pyrimidine dihydrochloride IUPAC Name: 2-[4-[(4-methoxy-3-phenylphenyl)methyl]piperazin-1-yl]pyrimidine dihydrochloride Traditional Name: 2-[4-(4-methoxy-3-phenyl-benzyl)piperazino]pyrimidine dihydrochloride Formula: C22H26Cl2N4O MolecularWeight: 433.37404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=NC=CC=N3)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=NC=CC=N3)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C22H24N4O.2ClH/c1-27-21-9-8-18(16-20(21)19-6-3-2-4-7-19)17-25-12-14-26(15-13-25)22-23-10-5-11-24-22;;/h2-11,16H,12-15,17H2,1H3;2*1H