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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC#N

InChI

InChI=1S/C25H31N/c1-2-3-4-5-20-6-10-22(11-7-20)24-14-16-25(17-15-24)23-12-8-21(9-13-23)18-19-26/h8-9,12-17,20,22H,2-7,10-11,18H2,1H3