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

Systemtic Name: 2-[2-oxidanylidene-1-[3-(1-piperidin-1-ylpropoxy)phenyl]-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[2-oxo-1-[3-[1-(1-piperidyl)propoxy]phenyl]-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[2-oxo-1-[3-[1-(1-piperidinyl)propoxy]phenyl]-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[2-oxo-1-[3-(1-piperidin-1-ylpropoxy)phenyl]-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[2-keto-1-[3-(1-piperidinopropoxy)phenyl]-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C31H30N4O2 MolecularWeight: 490.5955

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCCCC1)OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

Isomeric SMILES

CCC(N1CCCCC1)OC2=CC=CC(=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

InChI

InChI=1S/C31H30N4O2/c1-2-30(34-17-8-3-9-18-34)37-26-13-10-12-25(20-26)35-22-24(29-15-6-7-16-33-29)19-28(31(35)36)27-14-5-4-11-23(27)21-32/h4-7,10-16,19-20,22,30H,2-3,8-9,17-18H2,1H3