ethyl 4-methyl-5-oxidanylidene-1-(6-oxidanylidene-4-phenyl-1,2-diazinan-3-yl)-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-oxidanylidene-1-(6-oxidanylidene-4-phenyl-1,2-diazinan-3-yl)-4H-pyrazole-3-carboxylate Openeye Name: ethyl 4-methyl-5-oxo-1-(6-oxo-4-phenyl-hexahydropyridazin-3-yl)-4H-pyrazole-3-carboxylate CAS Name: 4-methyl-5-oxo-1-(6-oxo-4-phenyl-3-diazinanyl)-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-oxo-1-(6-oxo-4-phenyldiazinan-3-yl)-4H-pyrazole-3-carboxylate Traditional Name: 5-keto-1-(6-keto-4-phenyl-hexahydropyridazin-3-yl)-4-methyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1C)C2C(CC(=O)NN2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C1C)C2C(CC(=O)NN2)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O4/c1-3-25-17(24)14-10(2)16(23)21(20-14)15-12(9-13(22)18-19-15)11-7-5-4-6-8-11/h4-8,10,12,15,19H,3,9H2,1-2H3,(H,18,22)