4-[4-(4-nonoxyphenyl)phenyl]-1-pentyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-pentyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-pentyl-cyclohexanecarbonitrile CAS Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-pentyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-pentylcyclohexane-1-carbonitrile Traditional Name: 1-amyl-4-[4-(4-nonoxyphenyl)phenyl]cyclohexanecarbonitrile Formula: C33H47NO MolecularWeight: 473.73238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCCC)C#N

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCCC)C#N

InChI

InChI=1S/C33H47NO/c1-3-5-7-8-9-10-12-26-35-32-19-17-30(18-20-32)28-13-15-29(16-14-28)31-21-24-33(27-34,25-22-31)23-11-6-4-2/h13-20,31H,3-12,21-26H2,1-2H3