4-[4-[3-(6-oxidanylideneoxan-2-yl)pyridin-2-yl]butyl]benzenecarbonitrile

Systemtic Name: 4-[4-[3-(6-oxidanylideneoxan-2-yl)pyridin-2-yl]butyl]benzenecarbonitrile Openeye Name: 4-[4-[3-(6-oxotetrahydropyran-2-yl)-2-pyridyl]butyl]benzonitrile CAS Name: 4-[4-[3-(6-oxo-2-oxanyl)-2-pyridinyl]butyl]benzonitrile IUPAC Name: 4-[4-[3-(6-oxooxan-2-yl)pyridin-2-yl]butyl]benzonitrile Traditional Name: 4-[4-[3-(6-ketotetrahydropyran-2-yl)-2-pyridyl]butyl]benzonitrile Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC(=O)C1)C2=C(N=CC=C2)CCCCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(OC(=O)C1)C2=C(N=CC=C2)CCCCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H22N2O2/c22-15-17-12-10-16(11-13-17)5-1-2-7-19-18(6-4-14-23-19)20-8-3-9-21(24)25-20/h4,6,10-14,20H,1-3,5,7-9H2