4-(5-hexyl-6-oxidanylidene-oxan-2-yl)benzenecarbonitrile

Systemtic Name: 4-(5-hexyl-6-oxidanylidene-oxan-2-yl)benzenecarbonitrile Openeye Name: 4-(5-hexyl-6-oxo-tetrahydropyran-2-yl)benzonitrile CAS Name: 4-(5-hexyl-6-oxo-2-oxanyl)benzonitrile IUPAC Name: 4-(5-hexyl-6-oxooxan-2-yl)benzonitrile Traditional Name: 4-(5-hexyl-6-keto-tetrahydropyran-2-yl)benzonitrile Formula: C18H23NO2 MolecularWeight: 285.38072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(OC1=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCC1CCC(OC1=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H23NO2/c1-2-3-4-5-6-16-11-12-17(21-18(16)20)15-9-7-14(13-19)8-10-15/h7-10,16-17H,2-6,11-12H2,1H3