methyl 1-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-4-iodanyl-pyrazole-3-carboxylate

Systemtic Name: methyl 1-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-4-iodanyl-pyrazole-3-carboxylate Openeye Name: methyl 1-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-4-iodo-pyrazole-3-carboxylate CAS Name: 1-(1,3-dihydroxypropan-2-yloxymethyl)-4-iodo-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(1,3-dihydroxypropan-2-yloxymethyl)-4-iodopyrazole-3-carboxylate Traditional Name: 1-[(2-hydroxy-1-methylol-ethoxy)methyl]-4-iodo-pyrazole-3-carboxylic acid methyl ester Formula: C9H13IN2O5 MolecularWeight: 356.11439

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1I)COC(CO)CO

Isomeric SMILES

COC(=O)C1=NN(C=C1I)COC(CO)CO

InChI

InChI=1S/C9H13IN2O5/c1-16-9(15)8-7(10)2-12(11-8)5-17-6(3-13)4-14/h2,6,13-14H,3-5H2,1H3