3-[4-[2-(4-propylcyclohexyl)ethyl]phenyl]prop-2-ynenitrile

Systemtic Name: 3-[4-[2-(4-propylcyclohexyl)ethyl]phenyl]prop-2-ynenitrile Openeye Name: 3-[4-[2-(4-propylcyclohexyl)ethyl]phenyl]prop-2-ynenitrile CAS Name: 3-[4-[2-(4-propylcyclohexyl)ethyl]phenyl]-2-propynenitrile IUPAC Name: 3-[4-[2-(4-propylcyclohexyl)ethyl]phenyl]prop-2-ynenitrile Traditional Name: 3-[4-[2-(4-propylcyclohexyl)ethyl]phenyl]propiolonitrile Formula: C20H25N MolecularWeight: 279.4192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)CCC2=CC=C(C=C2)C#CC#N

Isomeric SMILES

CCCC1CCC(CC1)CCC2=CC=C(C=C2)C#CC#N

InChI

InChI=1S/C20H25N/c1-2-4-17-6-10-19(11-7-17)14-15-20-12-8-18(9-13-20)5-3-16-21/h8-9,12-13,17,19H,2,4,6-7,10-11,14-15H2,1H3