2-[2-oxidanylidene-1-[3-[1-(phenylmethyl)piperidin-4-yl]oxyphenyl]-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[2-oxidanylidene-1-[3-[1-(phenylmethyl)piperidin-4-yl]oxyphenyl]-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[1-[3-[(1-benzyl-4-piperidyl)oxy]phenyl]-2-oxo-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[2-oxo-1-[3-[[1-(phenylmethyl)-4-piperidinyl]oxy]phenyl]-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[1-[3-(1-benzylpiperidin-4-yl)oxyphenyl]-2-oxo-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[1-[3-[(1-benzyl-4-piperidyl)oxy]phenyl]-2-keto-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C35H30N4O2 MolecularWeight: 538.6383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5)CC6=CC=CC=C6

InChI

InChI=1S/C35H30N4O2/c36-23-27-11-4-5-14-32(27)33-21-28(34-15-6-7-18-37-34)25-39(35(33)40)29-12-8-13-31(22-29)41-30-16-19-38(20-17-30)24-26-9-2-1-3-10-26/h1-15,18,21-22,25,30H,16-17,19-20,24H2