ethyl (2R)-2-cyano-2-(5,6-diphenyl-1,2,4-triazin-3-yl)ethanoate

Systemtic Name: ethyl (2R)-2-cyano-2-(5,6-diphenyl-1,2,4-triazin-3-yl)ethanoate Openeye Name: ethyl (2R)-2-cyano-2-(5,6-diphenyl-1,2,4-triazin-3-yl)acetate CAS Name: (2R)-2-cyano-2-(5,6-diphenyl-1,2,4-triazin-3-yl)acetic acid ethyl ester IUPAC Name: ethyl (2R)-2-cyano-2-(5,6-diphenyl-1,2,4-triazin-3-yl)acetate Traditional Name: (2R)-2-cyano-2-(5,6-diphenyl-1,2,4-triazin-3-yl)acetic acid ethyl ester Formula: C20H16N4O2 MolecularWeight: 344.36664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H](C#N)C1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H16N4O2/c1-2-26-20(25)16(13-21)19-22-17(14-9-5-3-6-10-14)18(23-24-19)15-11-7-4-8-12-15/h3-12,16H,2H2,1H3/t16-/m1/s1