4-chloranyl-2-[3-(4-methylpiperazin-1-yl)-1-phenyl-propoxy]benzenecarbonitrile dihydrochloride

Systemtic Name: 4-chloranyl-2-[3-(4-methylpiperazin-1-yl)-1-phenyl-propoxy]benzenecarbonitrile dihydrochloride Openeye Name: 4-chloro-2-[3-(4-methylpiperazin-1-yl)-1-phenyl-propoxy]benzonitrile dihydrochloride CAS Name: 4-chloro-2-[3-(4-methyl-1-piperazinyl)-1-phenylpropoxy]benzonitrile dihydrochloride IUPAC Name: 4-chloro-2-[3-(4-methylpiperazin-1-yl)-1-phenylpropoxy]benzonitrile dihydrochloride Traditional Name: 4-chloro-2-[3-(4-methylpiperazino)-1-phenyl-propoxy]benzonitrile dihydrochloride Formula: C21H26Cl3N3O MolecularWeight: 442.80964

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC(C2=CC=CC=C2)OC3=C(C=CC(=C3)Cl)C#N.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CCC(C2=CC=CC=C2)OC3=C(C=CC(=C3)Cl)C#N.Cl.Cl

InChI

InChI=1S/C21H24ClN3O.2ClH/c1-24-11-13-25(14-12-24)10-9-20(17-5-3-2-4-6-17)26-21-15-19(22)8-7-18(21)16-23;;/h2-8,15,20H,9-14H2,1H3;2*1H