1-octyl-2-[4-[4-(11-oxidanylundecoxy)phenyl]phenyl]cyclohexane-1-carbonitrile

Systemtic Name: 1-octyl-2-[4-[4-(11-oxidanylundecoxy)phenyl]phenyl]cyclohexane-1-carbonitrile Openeye Name: 2-[4-[4-(11-hydroxyundecoxy)phenyl]phenyl]-1-octyl-cyclohexanecarbonitrile CAS Name: 2-[4-[4-(11-hydroxyundecoxy)phenyl]phenyl]-1-octyl-1-cyclohexanecarbonitrile IUPAC Name: 2-[4-[4-(11-hydroxyundecoxy)phenyl]phenyl]-1-octylcyclohexane-1-carbonitrile Traditional Name: 2-[4-[4-(11-hydroxyundecoxy)phenyl]phenyl]-1-octyl-cyclohexanecarbonitrile Formula: C38H57NO2 MolecularWeight: 559.86468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(CCCCC1C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCCCCCO)C#N

Isomeric SMILES

CCCCCCCCC1(CCCCC1C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCCCCCO)C#N

InChI

InChI=1S/C38H57NO2/c1-2-3-4-5-11-15-28-38(32-39)29-16-14-19-37(38)35-22-20-33(21-23-35)34-24-26-36(27-25-34)41-31-18-13-10-8-6-7-9-12-17-30-40/h20-27,37,40H,2-19,28-31H2,1H3