4-(5-nonyloxan-2-yl)benzenecarbonitrile

Systemtic Name: 4-(5-nonyloxan-2-yl)benzenecarbonitrile Openeye Name: 4-(5-nonyltetrahydropyran-2-yl)benzonitrile CAS Name: 4-(5-nonyl-2-oxanyl)benzonitrile IUPAC Name: 4-(5-nonyloxan-2-yl)benzonitrile Traditional Name: 4-(5-nonyltetrahydropyran-2-yl)benzonitrile Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(OC1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCCCCC1CCC(OC1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H31NO/c1-2-3-4-5-6-7-8-9-19-12-15-21(23-17-19)20-13-10-18(16-22)11-14-20/h10-11,13-14,19,21H,2-9,12,15,17H2,1H3