2-[4-[4-(4-octylcyclohexyl)phenyl]phenyl]ethanenitrile

Systemtic Name: 2-[4-[4-(4-octylcyclohexyl)phenyl]phenyl]ethanenitrile Openeye Name: 2-[4-[4-(4-octylcyclohexyl)phenyl]phenyl]acetonitrile CAS Name: 2-[4-[4-(4-octylcyclohexyl)phenyl]phenyl]acetonitrile IUPAC Name: 2-[4-[4-(4-octylcyclohexyl)phenyl]phenyl]acetonitrile Traditional Name: 2-[4-[4-(4-octylcyclohexyl)phenyl]phenyl]acetonitrile Formula: C28H37N MolecularWeight: 387.60008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC#N

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC#N

InChI

InChI=1S/C28H37N/c1-2-3-4-5-6-7-8-23-9-13-25(14-10-23)27-17-19-28(20-18-27)26-15-11-24(12-16-26)21-22-29/h11-12,15-20,23,25H,2-10,13-14,21H2,1H3