ethyl 2-cyano-3-(1,5-diphenyl-1,2,4-triazol-3-yl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 2-cyano-3-(1,5-diphenyl-1,2,4-triazol-3-yl)-3-oxidanylidene-propanoate Openeye Name: ethyl 2-cyano-3-(1,5-diphenyl-1,2,4-triazol-3-yl)-3-oxo-propanoate CAS Name: 2-cyano-3-(1,5-diphenyl-1,2,4-triazol-3-yl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-(1,5-diphenyl-1,2,4-triazol-3-yl)-3-oxopropanoate Traditional Name: 2-cyano-3-(1,5-diphenyl-1,2,4-triazol-3-yl)-3-keto-propionic acid ethyl ester Formula: C20H16N4O3 MolecularWeight: 360.36604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N4O3/c1-2-27-20(26)16(13-21)17(25)18-22-19(14-9-5-3-6-10-14)24(23-18)15-11-7-4-8-12-15/h3-12,16H,2H2,1H3