3-[4-[(2-methoxy-2-oxidanylidene-ethyl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[(2-methoxy-2-oxidanylidene-ethyl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[(2-methoxy-2-oxo-ethyl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[(2-methoxy-2-oxoethyl)sulfamoyl]-3,5-dimethyl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[(2-methoxy-2-oxoethyl)sulfamoyl]-3,5-dimethylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[(2-keto-2-methoxy-ethyl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propionic acid Formula: C11H17N3O6S MolecularWeight: 319.33418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)NCC(=O)OC

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)NCC(=O)OC

InChI

InChI=1S/C11H17N3O6S/c1-7-11(21(18,19)12-6-10(17)20-3)8(2)14(13-7)5-4-9(15)16/h12H,4-6H2,1-3H3,(H,15,16)