methyl 3-(3-chloranyl-6-methoxy-pyridin-2-yl)-5-(methylcarbamoyloxysulfonyl)-1H-pyrazole-4-carboxylate

Systemtic Name: methyl 3-(3-chloranyl-6-methoxy-pyridin-2-yl)-5-(methylcarbamoyloxysulfonyl)-1H-pyrazole-4-carboxylate Openeye Name: methyl 3-(3-chloro-6-methoxy-2-pyridyl)-5-(methylcarbamoyloxysulfonyl)-1H-pyrazole-4-carboxylate CAS Name: 3-(3-chloro-6-methoxy-2-pyridinyl)-5-(methylcarbamoyloxysulfonyl)-1H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-(3-chloro-6-methoxypyridin-2-yl)-5-(methylcarbamoyloxysulfonyl)-1H-pyrazole-4-carboxylate Traditional Name: 3-(3-chloro-6-methoxy-2-pyridyl)-5-(methylcarbamoyloxysulfonyl)-1H-pyrazole-4-carboxylic acid methyl ester Formula: C13H13ClN4O7S MolecularWeight: 404.78292

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OS(=O)(=O)C1=C(C(=NN1)C2=C(C=CC(=N2)OC)Cl)C(=O)OC

Isomeric SMILES

CNC(=O)OS(=O)(=O)C1=C(C(=NN1)C2=C(C=CC(=N2)OC)Cl)C(=O)OC

InChI

InChI=1S/C13H13ClN4O7S/c1-15-13(20)25-26(21,22)11-8(12(19)24-3)10(17-18-11)9-6(14)4-5-7(16-9)23-2/h4-5H,1-3H3,(H,15,20)(H,17,18)