2-[4-[4-[4-(2-methylbutyl)cyclohexyl]phenyl]phenyl]ethanenitrile

Systemtic Name: 2-[4-[4-[4-(2-methylbutyl)cyclohexyl]phenyl]phenyl]ethanenitrile Openeye Name: 2-[4-[4-[4-(2-methylbutyl)cyclohexyl]phenyl]phenyl]acetonitrile CAS Name: 2-[4-[4-[4-(2-methylbutyl)cyclohexyl]phenyl]phenyl]acetonitrile IUPAC Name: 2-[4-[4-[4-(2-methylbutyl)cyclohexyl]phenyl]phenyl]acetonitrile Traditional Name: 2-[4-[4-[4-(2-methylbutyl)cyclohexyl]phenyl]phenyl]acetonitrile Formula: C25H31N MolecularWeight: 345.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC#N

Isomeric SMILES

CCC(C)CC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC#N

InChI

InChI=1S/C25H31N/c1-3-19(2)18-21-6-10-23(11-7-21)25-14-12-24(13-15-25)22-8-4-20(5-9-22)16-17-26/h4-5,8-9,12-15,19,21,23H,3,6-7,10-11,16,18H2,1-2H3