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

Systemtic Name: 4-[4-methoxy-3-[[(2-phenylpiperidin-3-yl)amino]methyl]phenyl]oxane-4-carbonitrile dihydrochloride Openeye Name: 4-[4-methoxy-3-[[(2-phenyl-3-piperidyl)amino]methyl]phenyl]tetrahydropyran-4-carbonitrile dihydrochloride CAS Name: 4-[4-methoxy-3-[[(2-phenyl-3-piperidinyl)amino]methyl]phenyl]-4-oxanecarbonitrile dihydrochloride IUPAC Name: 4-[4-methoxy-3-[[(2-phenylpiperidin-3-yl)amino]methyl]phenyl]oxane-4-carbonitrile dihydrochloride Traditional Name: 4-[4-methoxy-3-[[(2-phenyl-3-piperidyl)amino]methyl]phenyl]tetrahydropyran-4-carbonitrile dihydrochloride Formula: C25H33Cl2N3O2 MolecularWeight: 478.45442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCOCC2)C#N)CNC3CCCNC3C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCOCC2)C#N)CNC3CCCNC3C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C25H31N3O2.2ClH/c1-29-23-10-9-21(25(18-26)11-14-30-15-12-25)16-20(23)17-28-22-8-5-13-27-24(22)19-6-3-2-4-7-19;;/h2-4,6-7,9-10,16,22,24,27-28H,5,8,11-15,17H2,1H3;2*1H