ethyl 3,5-bis(4-cyanophenyl)pentanoate

Systemtic Name: ethyl 3,5-bis(4-cyanophenyl)pentanoate Openeye Name: ethyl 3,5-bis(4-cyanophenyl)pentanoate CAS Name: 3,5-bis(4-cyanophenyl)pentanoic acid ethyl ester IUPAC Name: ethyl 3,5-bis(4-cyanophenyl)pentanoate Traditional Name: 3,5-bis(4-cyanophenyl)valeric acid ethyl ester Formula: C21H20N2O2 MolecularWeight: 332.3957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCC1=CC=C(C=C1)C#N)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)CC(CCC1=CC=C(C=C1)C#N)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H20N2O2/c1-2-25-21(24)13-20(19-10-8-18(15-23)9-11-19)12-7-16-3-5-17(14-22)6-4-16/h3-6,8-11,20H,2,7,12-13H2,1H3