4-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-dipyridin-2-yl-butanenitrile

Systemtic Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-dipyridin-2-yl-butanenitrile Openeye Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-bis(2-pyridyl)butanenitrile CAS Name: 4-[4-(2-methoxyphenyl)-1-piperazinyl]-2,2-bis(2-pyridinyl)butanenitrile IUPAC Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-dipyridin-2-ylbutanenitrile Traditional Name: 4-[4-(2-methoxyphenyl)piperazino]-2,2-bis(2-pyridyl)butyronitrile Formula: C25H27N5O MolecularWeight: 413.51478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCC(C#N)(C3=CC=CC=N3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCC(C#N)(C3=CC=CC=N3)C4=CC=CC=N4

InChI

InChI=1S/C25H27N5O/c1-31-22-9-3-2-8-21(22)30-18-16-29(17-19-30)15-12-25(20-26,23-10-4-6-13-27-23)24-11-5-7-14-28-24/h2-11,13-14H,12,15-19H2,1H3