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

Systemtic Name: 4-[4-(2-oxidanylideneoxan-3-yl)butyl]benzenecarbonitrile Openeye Name: 4-[4-(2-oxotetrahydropyran-3-yl)butyl]benzonitrile CAS Name: 4-[4-(2-oxo-3-oxanyl)butyl]benzonitrile IUPAC Name: 4-[4-(2-oxooxan-3-yl)butyl]benzonitrile Traditional Name: 4-[4-(2-ketotetrahydropyran-3-yl)butyl]benzonitrile Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)OC1)CCCCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CC(C(=O)OC1)CCCCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H19NO2/c17-12-14-9-7-13(8-10-14)4-1-2-5-15-6-3-11-19-16(15)18/h7-10,15H,1-6,11H2