4-[4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]-1-pentyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]-1-pentyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]-1-pentyl-cyclohexanecarbonitrile CAS Name: 4-[4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]-1-pentyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]-1-pentylcyclohexane-1-carbonitrile Traditional Name: 1-amyl-4-[4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]cyclohexanecarbonitrile Formula: C34H49NO MolecularWeight: 487.75896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCC(C)CCCC(C)C)C#N

Isomeric SMILES

CCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCC(C)CCCC(C)C)C#N

InChI

InChI=1S/C34H49NO/c1-5-6-7-22-34(26-35)23-19-32(20-24-34)30-13-11-29(12-14-30)31-15-17-33(18-16-31)36-25-21-28(4)10-8-9-27(2)3/h11-18,27-28,32H,5-10,19-25H2,1-4H3