diethyl 2-[[(4-aminocarbonyl-5-methyl-1H-pyrazol-3-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(4-aminocarbonyl-5-methyl-1H-pyrazol-3-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(4-carbamoyl-5-methyl-1H-pyrazol-3-yl)amino]methylene]propanedioate CAS Name: 2-[[(4-carbamoyl-5-methyl-1H-pyrazol-3-yl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(4-carbamoyl-5-methyl-1H-pyrazol-3-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(4-carbamoyl-5-methyl-1H-pyrazol-3-yl)amino]methylene]malonic acid diethyl ester Formula: C13H18N4O5 MolecularWeight: 310.30582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NNC(=C1C(=O)N)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NNC(=C1C(=O)N)C)C(=O)OCC

InChI

InChI=1S/C13H18N4O5/c1-4-21-12(19)8(13(20)22-5-2)6-15-11-9(10(14)18)7(3)16-17-11/h6H,4-5H2,1-3H3,(H2,14,18)(H2,15,16,17)