methyl 5-(2-iodanylphenyl)carbonyloxy-1-methyl-pyrazole-3-carboxylate

Systemtic Name: methyl 5-(2-iodanylphenyl)carbonyloxy-1-methyl-pyrazole-3-carboxylate Openeye Name: methyl 5-(2-iodobenzoyl)oxy-1-methyl-pyrazole-3-carboxylate CAS Name: 5-[(2-iodophenyl)-oxomethoxy]-1-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-iodobenzoyl)oxy-1-methylpyrazole-3-carboxylate Traditional Name: 5-(2-iodobenzoyl)oxy-1-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C13H11IN2O4 MolecularWeight: 386.14191

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)OC)OC(=O)C2=CC=CC=C2I

Isomeric SMILES

CN1C(=CC(=N1)C(=O)OC)OC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C13H11IN2O4/c1-16-11(7-10(15-16)13(18)19-2)20-12(17)8-5-3-4-6-9(8)14/h3-7H,1-2H3