diethyl 2-[[(6-aminocarbonylpyridazin-3-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(6-aminocarbonylpyridazin-3-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(6-carbamoylpyridazin-3-yl)amino]methylene]propanedioate CAS Name: 2-[[(6-carbamoyl-3-pyridazinyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(6-carbamoylpyridazin-3-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(6-carbamoylpyridazin-3-yl)amino]methylene]malonic acid diethyl ester Formula: C13H16N4O5 MolecularWeight: 308.28994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NN=C(C=C1)C(=O)N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NN=C(C=C1)C(=O)N)C(=O)OCC

InChI

InChI=1S/C13H16N4O5/c1-3-21-12(19)8(13(20)22-4-2)7-15-10-6-5-9(11(14)18)16-17-10/h5-7H,3-4H2,1-2H3,(H2,14,18)(H,15,17)