4-(3-methoxyphenyl)-1-[1-(phenylmethyl)piperidin-4-yl]piperidine-4-carbonitrile

Systemtic Name: 4-(3-methoxyphenyl)-1-[1-(phenylmethyl)piperidin-4-yl]piperidine-4-carbonitrile Openeye Name: 1-(1-benzyl-4-piperidyl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile CAS Name: 4-(3-methoxyphenyl)-1-[1-(phenylmethyl)-4-piperidinyl]-4-piperidinecarbonitrile IUPAC Name: 1-(1-benzylpiperidin-4-yl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile Traditional Name: 1-(1-benzyl-4-piperidyl)-4-(3-methoxyphenyl)isonipecotonitrile Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCN(CC2)C3CCN(CC3)CC4=CC=CC=C4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCN(CC2)C3CCN(CC3)CC4=CC=CC=C4)C#N

InChI

InChI=1S/C25H31N3O/c1-29-24-9-5-8-22(18-24)25(20-26)12-16-28(17-13-25)23-10-14-27(15-11-23)19-21-6-3-2-4-7-21/h2-9,18,23H,10-17,19H2,1H3