dimethyl 3-(6-chloranylpyridin-2-yl)carbonyl-1H-pyrazole-4,5-dicarboxylate

Systemtic Name: dimethyl 3-(6-chloranylpyridin-2-yl)carbonyl-1H-pyrazole-4,5-dicarboxylate Openeye Name: dimethyl 3-(6-chloropyridine-2-carbonyl)-1H-pyrazole-4,5-dicarboxylate CAS Name: 3-[(6-chloro-2-pyridinyl)-oxomethyl]-1H-pyrazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(6-chloropyridine-2-carbonyl)-1H-pyrazole-4,5-dicarboxylate Traditional Name: 3-(6-chloropicolinoyl)-1H-pyrazole-4,5-dicarboxylic acid dimethyl ester Formula: C13H10ClN3O5 MolecularWeight: 323.6886

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NN=C1C(=O)C2=NC(=CC=C2)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(NN=C1C(=O)C2=NC(=CC=C2)Cl)C(=O)OC

InChI

InChI=1S/C13H10ClN3O5/c1-21-12(19)8-9(16-17-10(8)13(20)22-2)11(18)6-4-3-5-7(14)15-6/h3-5H,1-2H3,(H,16,17)