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

Systemtic Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-octyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-octyl-cyclohexanecarbonitrile CAS Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-octyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-octylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-nonoxyphenyl)phenyl]-1-octyl-cyclohexanecarbonitrile Formula: C36H53NO MolecularWeight: 515.81212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H53NO/c1-3-5-7-9-11-13-15-29-38-35-22-20-33(21-23-35)31-16-18-32(19-17-31)34-24-27-36(30-37,28-25-34)26-14-12-10-8-6-4-2/h16-23,34H,3-15,24-29H2,1-2H3