ethyl 4-azanylidene-1-(4-chlorophenyl)-5-cyano-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-azanylidene-1-(4-chlorophenyl)-5-cyano-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(4-chlorophenyl)-5-cyano-4-imino-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-chlorophenyl)-5-cyano-4-imino-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-chlorophenyl)-5-cyano-4-imino-6-oxopyridazine-3-carboxylate Traditional Name: 1-(4-chlorophenyl)-5-cyano-4-imino-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C14H11ClN4O3 MolecularWeight: 318.71514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN4O3/c1-2-22-14(21)12-11(17)10(7-16)13(20)19(18-12)9-5-3-8(15)4-6-9/h3-6,10,17H,2H2,1H3