4-[4-(6-hexyloxan-3-yl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(6-hexyloxan-3-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(6-hexyltetrahydropyran-3-yl)phenyl]benzonitrile CAS Name: 4-[4-(6-hexyl-3-oxanyl)phenyl]benzonitrile IUPAC Name: 4-[4-(6-hexyloxan-3-yl)phenyl]benzonitrile Traditional Name: 4-[4-(6-hexyltetrahydropyran-3-yl)phenyl]benzonitrile Formula: C24H29NO MolecularWeight: 347.49316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCC1CCC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H29NO/c1-2-3-4-5-6-24-16-15-23(18-26-24)22-13-11-21(12-14-22)20-9-7-19(17-25)8-10-20/h7-14,23-24H,2-6,15-16,18H2,1H3