4-[4-[2-(4-butyl-2-methyl-cyclohexyl)ethyl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-(4-butyl-2-methyl-cyclohexyl)ethyl]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-(4-butyl-2-methyl-cyclohexyl)ethyl]phenyl]benzonitrile CAS Name: 4-[4-[2-(4-butyl-2-methylcyclohexyl)ethyl]phenyl]benzonitrile IUPAC Name: 4-[4-[2-(4-butyl-2-methylcyclohexyl)ethyl]phenyl]benzonitrile Traditional Name: 4-[4-[2-(4-butyl-2-methyl-cyclohexyl)ethyl]phenyl]benzonitrile Formula: C26H33N MolecularWeight: 359.54692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(C(C1)C)CCC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCC1CCC(C(C1)C)CCC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H33N/c1-3-4-5-22-9-13-24(20(2)18-22)12-6-21-7-14-25(15-8-21)26-16-10-23(19-27)11-17-26/h7-8,10-11,14-17,20,22,24H,3-6,9,12-13,18H2,1-2H3