4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzonitrile CAS Name: 4-[4-[2-[4-(4-ethylcyclohexyl)-1-cyclohexenyl]ethynyl]phenyl]benzonitrile IUPAC Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzonitrile Traditional Name: 4-[4-[2-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzonitrile Formula: C29H31N MolecularWeight: 393.56314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCC1CCC(CC1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C29H31N/c1-2-22-5-13-26(14-6-22)27-15-7-23(8-16-27)3-4-24-9-17-28(18-10-24)29-19-11-25(21-30)12-20-29/h7,9-12,17-20,22,26-27H,2,5-6,8,13-16H2,1H3