4-(6-hexyl-2-oxidanylidene-oxan-3-yl)benzenecarbonitrile

Systemtic Name: 4-(6-hexyl-2-oxidanylidene-oxan-3-yl)benzenecarbonitrile Openeye Name: 4-(6-hexyl-2-oxo-tetrahydropyran-3-yl)benzonitrile CAS Name: 4-(6-hexyl-2-oxo-3-oxanyl)benzonitrile IUPAC Name: 4-(6-hexyl-2-oxooxan-3-yl)benzonitrile Traditional Name: 4-(6-hexyl-2-keto-tetrahydropyran-3-yl)benzonitrile Formula: C18H23NO2 MolecularWeight: 285.38072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(C(=O)O1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCC1CCC(C(=O)O1)C2=CC=C(C=C2)C#N

InChI

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