ethyl 4-cyano-3-phenyl-4-pyridin-3-yl-butanoate

Systemtic Name: ethyl 4-cyano-3-phenyl-4-pyridin-3-yl-butanoate Openeye Name: ethyl 4-cyano-3-phenyl-4-(3-pyridyl)butanoate CAS Name: 4-cyano-3-phenyl-4-(3-pyridinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-phenyl-4-pyridin-3-ylbutanoate Traditional Name: 4-cyano-3-phenyl-4-(3-pyridyl)butyric acid ethyl ester Formula: C18H18N2O2 MolecularWeight: 294.34772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O2/c1-2-22-18(21)11-16(14-7-4-3-5-8-14)17(12-19)15-9-6-10-20-13-15/h3-10,13,16-17H,2,11H2,1H3