2,5-dimethyl-1-(3-sulfamoylphenyl)pyrrole-3-carboxylic acid

Systemtic Name: 2,5-dimethyl-1-(3-sulfamoylphenyl)pyrrole-3-carboxylic acid Openeye Name: 2,5-dimethyl-1-(3-sulfamoylphenyl)pyrrole-3-carboxylic acid CAS Name: 2,5-dimethyl-1-(3-sulfamoylphenyl)-3-pyrrolecarboxylic acid IUPAC Name: 2,5-dimethyl-1-(3-sulfamoylphenyl)pyrrole-3-carboxylic acid Traditional Name: 2,5-dimethyl-1-(3-sulfamoylphenyl)pyrrole-3-carboxylic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N)C)C(=O)O

InChI

InChI=1S/C13H14N2O4S/c1-8-6-12(13(16)17)9(2)15(8)10-4-3-5-11(7-10)20(14,18)19/h3-7H,1-2H3,(H,16,17)(H2,14,18,19)