1-methyl-4-[(2-methylphenyl)sulfamoyl]pyrrole-2-carboxylic acid

Systemtic Name: 1-methyl-4-[(2-methylphenyl)sulfamoyl]pyrrole-2-carboxylic acid Openeye Name: 1-methyl-4-(o-tolylsulfamoyl)pyrrole-2-carboxylic acid CAS Name: 1-methyl-4-[(2-methylphenyl)sulfamoyl]-2-pyrrolecarboxylic acid IUPAC Name: 1-methyl-4-[(2-methylphenyl)sulfamoyl]pyrrole-2-carboxylic acid Traditional Name: 1-methyl-4-(o-tolylsulfamoyl)pyrrole-2-carboxylic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CN(C(=C2)C(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CN(C(=C2)C(=O)O)C

InChI

InChI=1S/C13H14N2O4S/c1-9-5-3-4-6-11(9)14-20(18,19)10-7-12(13(16)17)15(2)8-10/h3-8,14H,1-2H3,(H,16,17)