ethyl 2,2,8-tricyano-5-oxidanylidene-7-phenyl-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate

Systemtic Name: ethyl 2,2,8-tricyano-5-oxidanylidene-7-phenyl-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate Openeye Name: ethyl 2,2,8-tricyano-5-oxo-7-phenyl-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate CAS Name: 2,2,8-tricyano-5-oxo-7-phenyl-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2,2,8-tricyano-5-oxo-7-phenyl-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate Traditional Name: 2,2,8-tricyano-5-keto-7-phenyl-1,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid ethyl ester Formula: C18H12N6O3 MolecularWeight: 360.32628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2NC(NN2C1=O)(C#N)C#N)C#N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C2NC(NN2C1=O)(C#N)C#N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H12N6O3/c1-2-27-17(26)14-13(11-6-4-3-5-7-11)12(8-19)15-22-18(9-20,10-21)23-24(15)16(14)25/h3-7,22-23H,2H2,1H3