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

Systemtic Name: 1-(3-methoxyphenyl)-4-piperazin-1-yl-cyclohexane-1-carbonitrile dihydrochloride Openeye Name: 1-(3-methoxyphenyl)-4-piperazin-1-yl-cyclohexanecarbonitrile dihydrochloride CAS Name: 1-(3-methoxyphenyl)-4-(1-piperazinyl)-1-cyclohexanecarbonitrile dihydrochloride IUPAC Name: 1-(3-methoxyphenyl)-4-piperazin-1-ylcyclohexane-1-carbonitrile dihydrochloride Traditional Name: 1-(3-methoxyphenyl)-4-piperazino-cyclohexanecarbonitrile dihydrochloride Formula: C18H27Cl2N3O MolecularWeight: 372.33248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCC(CC2)N3CCNCC3)C#N.Cl.Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCC(CC2)N3CCNCC3)C#N.Cl.Cl

InChI

InChI=1S/C18H25N3O.2ClH/c1-22-17-4-2-3-15(13-17)18(14-19)7-5-16(6-8-18)21-11-9-20-10-12-21;;/h2-4,13,16,20H,5-12H2,1H3;2*1H