2-[2-oxidanylidene-1-[3-(4-piperidin-1-ylbutoxy)phenyl]-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[2-oxidanylidene-1-[3-(4-piperidin-1-ylbutoxy)phenyl]-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[2-oxo-1-[3-[4-(1-piperidyl)butoxy]phenyl]-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[2-oxo-1-[3-[4-(1-piperidinyl)butoxy]phenyl]-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[2-oxo-1-[3-(4-piperidin-1-ylbutoxy)phenyl]-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[2-keto-1-[3-(4-piperidinobutoxy)phenyl]-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C32H32N4O2 MolecularWeight: 504.62208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCOC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

Isomeric SMILES

C1CCN(CC1)CCCCOC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

InChI

InChI=1S/C32H32N4O2/c33-23-25-11-2-3-14-29(25)30-21-26(31-15-4-5-16-34-31)24-36(32(30)37)27-12-10-13-28(22-27)38-20-9-8-19-35-17-6-1-7-18-35/h2-5,10-16,21-22,24H,1,6-9,17-20H2