4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]-3-methyl-benzenecarbonitrile

Systemtic Name: 4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]-3-methyl-benzenecarbonitrile Openeye Name: 4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]-3-methyl-benzonitrile CAS Name: 4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]-3-methylbenzonitrile IUPAC Name: 4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]-3-methylbenzonitrile Traditional Name: 4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]-3-methyl-benzonitrile Formula: C35H43N MolecularWeight: 477.72262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)C4=C(C=C(C=C4)C#N)C

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)C4=C(C=C(C=C4)C#N)C

InChI

InChI=1S/C35H43N/c1-3-4-5-6-7-8-28-11-18-32(19-12-28)33-20-13-29(14-21-33)9-10-30-15-22-34(23-16-30)35-24-17-31(26-36)25-27(35)2/h13-17,20-25,28,32H,3-12,18-19H2,1-2H3