2-[4-[4-(4-hexoxyphenyl)phenyl]cyclohexyl]pentanenitrile

Systemtic Name: 2-[4-[4-(4-hexoxyphenyl)phenyl]cyclohexyl]pentanenitrile Openeye Name: 2-[4-[4-(4-hexoxyphenyl)phenyl]cyclohexyl]pentanenitrile CAS Name: 2-[4-[4-(4-hexoxyphenyl)phenyl]cyclohexyl]pentanenitrile IUPAC Name: 2-[4-[4-(4-hexoxyphenyl)phenyl]cyclohexyl]pentanenitrile Traditional Name: 2-[4-[4-(4-hexoxyphenyl)phenyl]cyclohexyl]valeronitrile Formula: C29H39NO MolecularWeight: 417.62606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)C(CCC)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)C(CCC)C#N

InChI

InChI=1S/C29H39NO/c1-3-5-6-7-21-31-29-19-17-26(18-20-29)25-11-9-23(10-12-25)24-13-15-27(16-14-24)28(22-30)8-4-2/h9-12,17-20,24,27-28H,3-8,13-16,21H2,1-2H3