ethyl (4E)-3-azanyl-4-(5-azanyl-2-ethoxycarbonyl-1H-pyrazol-3-ylidene)-5-oxidanylidene-pyrazole-1-carboxylate

Systemtic Name: ethyl (4E)-3-azanyl-4-(5-azanyl-2-ethoxycarbonyl-1H-pyrazol-3-ylidene)-5-oxidanylidene-pyrazole-1-carboxylate Openeye Name: ethyl (4E)-3-amino-4-(5-amino-2-ethoxycarbonyl-1H-pyrazol-3-ylidene)-5-oxo-pyrazole-1-carboxylate CAS Name: (4E)-3-amino-4-(5-amino-2-ethoxycarbonyl-1H-pyrazol-3-ylidene)-5-oxo-1-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl (4E)-3-amino-4-(5-amino-2-ethoxycarbonyl-1H-pyrazol-3-ylidene)-5-oxopyrazole-1-carboxylate Traditional Name: (4E)-3-amino-4-(5-amino-2-carbethoxy-3-pyrazolin-3-ylidene)-5-keto-2-pyrazoline-1-carboxylic acid ethyl ester Formula: C12H16N6O5 MolecularWeight: 324.29264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=C2C(=NN(C2=O)C(=O)OCC)N)C=C(N1)N

Isomeric SMILES

CCOC(=O)N1/C(=C/2\C(=NN(C2=O)C(=O)OCC)N)/C=C(N1)N

InChI

InChI=1S/C12H16N6O5/c1-3-22-11(20)17-6(5-7(13)15-17)8-9(14)16-18(10(8)19)12(21)23-4-2/h5,15H,3-4,13H2,1-2H3,(H2,14,16)/b8-6+