4-(1,3-benzodioxol-5-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(1,3-benzodioxol-5-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(1,3-benzodioxol-5-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(1,3-benzodioxol-5-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(1,3-benzodioxol-5-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(1,3-benzodioxol-5-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid Formula: C12H10N2O6S MolecularWeight: 310.2826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CNC(=C3)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CNC(=C3)C(=O)O

InChI

InChI=1S/C12H10N2O6S/c15-12(16)9-4-8(5-13-9)21(17,18)14-7-1-2-10-11(3-7)20-6-19-10/h1-5,13-14H,6H2,(H,15,16)