4-[(1-methoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)sulfamoylmethyl]benzoic acid

Systemtic Name: 4-[(1-methoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)sulfamoylmethyl]benzoic acid Openeye Name: 4-[[1-(hydroxymethyl)-2-methoxy-2-oxo-ethyl]sulfamoylmethyl]benzoic acid CAS Name: 4-[(3-hydroxy-1-methoxy-1-oxopropan-2-yl)sulfamoylmethyl]benzoic acid IUPAC Name: 4-[(3-hydroxy-1-methoxy-1-oxopropan-2-yl)sulfamoylmethyl]benzoic acid Traditional Name: 4-[(2-keto-2-methoxy-1-methylol-ethyl)sulfamoylmethyl]benzoic acid Formula: C12H15NO7S MolecularWeight: 317.315

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NS(=O)(=O)CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

COC(=O)C(CO)NS(=O)(=O)CC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H15NO7S/c1-20-12(17)10(6-14)13-21(18,19)7-8-2-4-9(5-3-8)11(15)16/h2-5,10,13-14H,6-7H2,1H3,(H,15,16)