4-chloranyl-2-(1-phenyl-3-piperazin-1-yl-propoxy)benzenecarbonitrile dihydrochloride

Systemtic Name: 4-chloranyl-2-(1-phenyl-3-piperazin-1-yl-propoxy)benzenecarbonitrile dihydrochloride Openeye Name: 4-chloro-2-(1-phenyl-3-piperazin-1-yl-propoxy)benzonitrile dihydrochloride CAS Name: 4-chloro-2-[1-phenyl-3-(1-piperazinyl)propoxy]benzonitrile dihydrochloride IUPAC Name: 4-chloro-2-(1-phenyl-3-piperazin-1-ylpropoxy)benzonitrile dihydrochloride Traditional Name: 4-chloro-2-(1-phenyl-3-piperazino-propoxy)benzonitrile dihydrochloride Formula: C20H24Cl3N3O MolecularWeight: 428.78306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCC(C2=CC=CC=C2)OC3=C(C=CC(=C3)Cl)C#N.Cl.Cl

Isomeric SMILES

C1CN(CCN1)CCC(C2=CC=CC=C2)OC3=C(C=CC(=C3)Cl)C#N.Cl.Cl

InChI

InChI=1S/C20H22ClN3O.2ClH/c21-18-7-6-17(15-22)20(14-18)25-19(16-4-2-1-3-5-16)8-11-24-12-9-23-10-13-24;;/h1-7,14,19,23H,8-13H2;2*1H