5-iodanyl-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-iodanyl-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-iodo-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-iodo-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-iodo-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-iodo-1-methyl-pyrazole-4-carboxylic acid Formula: C5H5IN2O2 MolecularWeight: 252.00987

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)I

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)I

InChI

InChI=1S/C5H5IN2O2/c1-8-4(6)3(2-7-8)5(9)10/h2H,1H3,(H,9,10)