3-[4-[4-[1-(3-bromanylpropyl)-4-bicyclo[2.2.2]octanyl]phenyl]phenyl]propanenitrile

Systemtic Name: 3-[4-[4-[1-(3-bromanylpropyl)-4-bicyclo[2.2.2]octanyl]phenyl]phenyl]propanenitrile Openeye Name: 3-[4-[4-[1-(3-bromopropyl)-4-bicyclo[2.2.2]octanyl]phenyl]phenyl]propanenitrile CAS Name: 3-[4-[4-[1-(3-bromopropyl)-4-bicyclo[2.2.2]octanyl]phenyl]phenyl]propanenitrile IUPAC Name: 3-[4-[4-[1-(3-bromopropyl)-4-bicyclo[2.2.2]octanyl]phenyl]phenyl]propanenitrile Traditional Name: 3-[4-[4-[1-(3-bromopropyl)-4-bicyclo[2.2.2]octanyl]phenyl]phenyl]propionitrile Formula: C26H30BrN MolecularWeight: 436.4271

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1(CC2)CCCBr)C3=CC=C(C=C3)C4=CC=C(C=C4)CCC#N

Isomeric SMILES

C1CC2(CCC1(CC2)CCCBr)C3=CC=C(C=C3)C4=CC=C(C=C4)CCC#N

InChI

InChI=1S/C26H30BrN/c27-19-2-12-25-13-16-26(17-14-25,18-15-25)24-10-8-23(9-11-24)22-6-4-21(5-7-22)3-1-20-28/h4-11H,1-3,12-19H2