1-(3-cyclopentyloxyphenyl)-4-piperazin-1-yl-cyclohexane-1-carbonitrile dihydrochloride

Systemtic Name: 1-(3-cyclopentyloxyphenyl)-4-piperazin-1-yl-cyclohexane-1-carbonitrile dihydrochloride Openeye Name: 1-[3-(cyclopentoxy)phenyl]-4-piperazin-1-yl-cyclohexanecarbonitrile dihydrochloride CAS Name: 1-(3-cyclopentyloxyphenyl)-4-(1-piperazinyl)-1-cyclohexanecarbonitrile dihydrochloride IUPAC Name: 1-(3-cyclopentyloxyphenyl)-4-piperazin-1-ylcyclohexane-1-carbonitrile dihydrochloride Traditional Name: 1-[3-(cyclopentoxy)phenyl]-4-piperazino-cyclohexanecarbonitrile dihydrochloride Formula: C22H33Cl2N3O MolecularWeight: 426.42292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=CC(=C2)C3(CCC(CC3)N4CCNCC4)C#N.Cl.Cl

Isomeric SMILES

C1CCC(C1)OC2=CC=CC(=C2)C3(CCC(CC3)N4CCNCC4)C#N.Cl.Cl

InChI

InChI=1S/C22H31N3O.2ClH/c23-17-22(10-8-19(9-11-22)25-14-12-24-13-15-25)18-4-3-7-21(16-18)26-20-5-1-2-6-20;;/h3-4,7,16,19-20,24H,1-2,5-6,8-15H2;2*1H