4-[(2,5-dimethyl-1H-pyrazol-2-ium-3-yl)sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-[(2,5-dimethyl-1H-pyrazol-2-ium-3-yl)sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-[(2,5-dimethyl-1H-pyrazol-2-ium-3-yl)sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[(2,5-dimethyl-1H-pyrazol-2-ium-3-yl)sulfamoyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[(2,5-dimethyl-1H-pyrazol-2-ium-3-yl)sulfamoyl]-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-[(2,5-dimethyl-1H-pyrazol-2-ium-3-yl)sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid Formula: C11H15N4O4S+ MolecularWeight: 299.3262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1)C)NS(=O)(=O)C2=CN(C(=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=[N+](N1)C)NS(=O)(=O)C2=CN(C(=C2)C(=O)O)C

InChI

InChI=1S/C11H14N4O4S/c1-7-4-10(15(3)12-7)13-20(18,19)8-5-9(11(16)17)14(2)6-8/h4-6H,1-3H3,(H2,12,13,16,17)/p+1