4-[(4-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[(4-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[(4-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(4-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[(4-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[(4-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NS(=O)(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)NS(=O)(=O)C2=CNC(=C2)C(=O)O

InChI

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