2-[4-(4-octan-2-yloxyphenyl)phenyl]-1-(8-oxidanyloctyl)cyclohexane-1-carbonitrile

Systemtic Name: 2-[4-(4-octan-2-yloxyphenyl)phenyl]-1-(8-oxidanyloctyl)cyclohexane-1-carbonitrile Openeye Name: 1-(8-hydroxyoctyl)-2-[4-[4-(1-methylheptoxy)phenyl]phenyl]cyclohexanecarbonitrile CAS Name: 1-(8-hydroxyoctyl)-2-[4-(4-octan-2-yloxyphenyl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-(8-hydroxyoctyl)-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 1-(8-hydroxyoctyl)-2-[4-[4-(1-methylheptoxy)phenyl]phenyl]cyclohexanecarbonitrile Formula: C35H51NO2 MolecularWeight: 517.78494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCCCC3(CCCCCCCCO)C#N

Isomeric SMILES

CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCCCC3(CCCCCCCCO)C#N

InChI

InChI=1S/C35H51NO2/c1-3-4-5-10-15-29(2)38-33-23-21-31(22-24-33)30-17-19-32(20-18-30)34-16-11-13-26-35(34,28-36)25-12-8-6-7-9-14-27-37/h17-24,29,34,37H,3-16,25-27H2,1-2H3