1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4-iodanyl-pyrazole-3-carboxylic acid

Systemtic Name: 1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4-iodanyl-pyrazole-3-carboxylic acid Openeye Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-iodo-pyrazole-3-carboxylic acid CAS Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-iodo-3-pyrazolecarboxylic acid IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-iodopyrazole-3-carboxylic acid Traditional Name: 1-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-4-iodo-pyrazole-3-carboxylic acid Formula: C9H11IN2O6 MolecularWeight: 370.09791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NN1C2C(C(C(O2)CO)O)O)C(=O)O)I

Isomeric SMILES

C1=C(C(=NN1C2C(C(C(O2)CO)O)O)C(=O)O)I

InChI

InChI=1S/C9H11IN2O6/c10-3-1-12(11-5(3)9(16)17)8-7(15)6(14)4(2-13)18-8/h1,4,6-8,13-15H,2H2,(H,16,17)