ethyl 5-methyl-5-oxidanyl-1-pyridin-3-ylcarbonyl-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-methyl-5-oxidanyl-1-pyridin-3-ylcarbonyl-4H-pyrazole-3-carboxylate Openeye Name: ethyl 5-hydroxy-5-methyl-1-(pyridine-3-carbonyl)-4H-pyrazole-3-carboxylate CAS Name: 5-hydroxy-5-methyl-1-[oxo(3-pyridinyl)methyl]-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-5-methyl-1-(pyridine-3-carbonyl)-4H-pyrazole-3-carboxylate Traditional Name: 5-hydroxy-5-methyl-1-nicotinoyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(C1)(C)O)C(=O)C2=CN=CC=C2

Isomeric SMILES

CCOC(=O)C1=NN(C(C1)(C)O)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C13H15N3O4/c1-3-20-12(18)10-7-13(2,19)16(15-10)11(17)9-5-4-6-14-8-9/h4-6,8,19H,3,7H2,1-2H3