5-octyl-2-oxidanylidene-oxolane-3-carbonitrile

Systemtic Name: 5-octyl-2-oxidanylidene-oxolane-3-carbonitrile Openeye Name: 5-octyl-2-oxo-tetrahydrofuran-3-carbonitrile CAS Name: 5-octyl-2-oxo-3-oxolanecarbonitrile IUPAC Name: 5-octyl-2-oxooxolane-3-carbonitrile Traditional Name: 2-keto-5-octyl-tetrahydrofuran-3-carbonitrile Formula: C13H21NO2 MolecularWeight: 223.31134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CC(C(=O)O1)C#N

Isomeric SMILES

CCCCCCCCC1CC(C(=O)O1)C#N

InChI

InChI=1S/C13H21NO2/c1-2-3-4-5-6-7-8-12-9-11(10-14)13(15)16-12/h11-12H,2-9H2,1H3