4-[4-(4-butylphenyl)phenyl]-1-hexyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(4-butylphenyl)phenyl]-1-hexyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-butylphenyl)phenyl]-1-hexyl-cyclohexanecarbonitrile CAS Name: 4-[4-(4-butylphenyl)phenyl]-1-hexyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-butylphenyl)phenyl]-1-hexylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-butylphenyl)phenyl]-1-hexyl-cyclohexanecarbonitrile Formula: C29H39N MolecularWeight: 401.62666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC)C#N

Isomeric SMILES

CCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC)C#N

InChI

InChI=1S/C29H39N/c1-3-5-7-8-20-29(23-30)21-18-28(19-22-29)27-16-14-26(15-17-27)25-12-10-24(11-13-25)9-6-4-2/h10-17,28H,3-9,18-22H2,1-2H3