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

Systemtic Name: 2-[4-methoxy-3-[[(2-phenylpiperidin-3-yl)amino]methyl]phenyl]-2-methyl-propanenitrile dihydrochloride Openeye Name: 2-[4-methoxy-3-[[(2-phenyl-3-piperidyl)amino]methyl]phenyl]-2-methyl-propanenitrile dihydrochloride CAS Name: 2-[4-methoxy-3-[[(2-phenyl-3-piperidinyl)amino]methyl]phenyl]-2-methylpropanenitrile dihydrochloride IUPAC Name: 2-[4-methoxy-3-[[(2-phenylpiperidin-3-yl)amino]methyl]phenyl]-2-methylpropanenitrile dihydrochloride Traditional Name: 2-[4-methoxy-3-[[(2-phenyl-3-piperidyl)amino]methyl]phenyl]-2-methyl-propionitrile dihydrochloride Formula: C23H31Cl2N3O MolecularWeight: 436.41774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC(=C(C=C1)OC)CNC2CCCNC2C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CC(C)(C#N)C1=CC(=C(C=C1)OC)CNC2CCCNC2C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C23H29N3O.2ClH/c1-23(2,16-24)19-11-12-21(27-3)18(14-19)15-26-20-10-7-13-25-22(20)17-8-5-4-6-9-17;;/h4-6,8-9,11-12,14,20,22,25-26H,7,10,13,15H2,1-3H3;2*1H