1-[4-methoxy-3-[[(2-phenylpiperidin-3-yl)amino]methyl]phenyl]cyclohexane-1-carbonitrile dihydrochloride

Systemtic Name: 1-[4-methoxy-3-[[(2-phenylpiperidin-3-yl)amino]methyl]phenyl]cyclohexane-1-carbonitrile dihydrochloride Openeye Name: 1-[4-methoxy-3-[[(2-phenyl-3-piperidyl)amino]methyl]phenyl]cyclohexanecarbonitrile dihydrochloride CAS Name: 1-[4-methoxy-3-[[(2-phenyl-3-piperidinyl)amino]methyl]phenyl]-1-cyclohexanecarbonitrile dihydrochloride IUPAC Name: 1-[4-methoxy-3-[[(2-phenylpiperidin-3-yl)amino]methyl]phenyl]cyclohexane-1-carbonitrile dihydrochloride Traditional Name: 1-[4-methoxy-3-[[(2-phenyl-3-piperidyl)amino]methyl]phenyl]cyclohexanecarbonitrile dihydrochloride Formula: C26H35Cl2N3O MolecularWeight: 476.4816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCCCC2)C#N)CNC3CCCNC3C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCCCC2)C#N)CNC3CCCNC3C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C26H33N3O.2ClH/c1-30-24-13-12-22(26(19-27)14-6-3-7-15-26)17-21(24)18-29-23-11-8-16-28-25(23)20-9-4-2-5-10-20;;/h2,4-5,9-10,12-13,17,23,25,28-29H,3,6-8,11,14-16,18H2,1H3;2*1H