3-ethyl-1-[2-[4-(4-hexoxyphenyl)phenyl]ethyl]cyclohexane-1-carbonitrile

Systemtic Name: 3-ethyl-1-[2-[4-(4-hexoxyphenyl)phenyl]ethyl]cyclohexane-1-carbonitrile Openeye Name: 3-ethyl-1-[2-[4-(4-hexoxyphenyl)phenyl]ethyl]cyclohexanecarbonitrile CAS Name: 3-ethyl-1-[2-[4-(4-hexoxyphenyl)phenyl]ethyl]-1-cyclohexanecarbonitrile IUPAC Name: 3-ethyl-1-[2-[4-(4-hexoxyphenyl)phenyl]ethyl]cyclohexane-1-carbonitrile Traditional Name: 3-ethyl-1-[2-[4-(4-hexoxyphenyl)phenyl]ethyl]cyclohexanecarbonitrile Formula: C29H39NO MolecularWeight: 417.62606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)CCC3(CCCC(C3)CC)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)CCC3(CCCC(C3)CC)C#N

InChI

InChI=1S/C29H39NO/c1-3-5-6-7-21-31-28-16-14-27(15-17-28)26-12-10-25(11-13-26)18-20-29(23-30)19-8-9-24(4-2)22-29/h10-17,24H,3-9,18-22H2,1-2H3