3-[4-[(1-methoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[(1-methoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[[1-(hydroxymethyl)-2-methoxy-2-oxo-ethyl]sulfamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[(3-hydroxy-1-methoxy-1-oxopropan-2-yl)sulfamoyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[(3-hydroxy-1-methoxy-1-oxopropan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[(2-keto-2-methoxy-1-methylol-ethyl)sulfamoyl]pyrazol-1-yl]propionic acid Formula: C10H15N3O7S MolecularWeight: 321.307

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NS(=O)(=O)C1=CN(N=C1)CCC(=O)O

Isomeric SMILES

COC(=O)C(CO)NS(=O)(=O)C1=CN(N=C1)CCC(=O)O

InChI

InChI=1S/C10H15N3O7S/c1-20-10(17)8(6-14)12-21(18,19)7-4-11-13(5-7)3-2-9(15)16/h4-5,8,12,14H,2-3,6H2,1H3,(H,15,16)