1-methyl-4-(pyridin-4-ylmethylsulfamoyl)pyrrole-2-carboxylic acid

Systemtic Name: 1-methyl-4-(pyridin-4-ylmethylsulfamoyl)pyrrole-2-carboxylic acid Openeye Name: 1-methyl-4-(4-pyridylmethylsulfamoyl)pyrrole-2-carboxylic acid CAS Name: 1-methyl-4-(pyridin-4-ylmethylsulfamoyl)-2-pyrrolecarboxylic acid IUPAC Name: 1-methyl-4-(pyridin-4-ylmethylsulfamoyl)pyrrole-2-carboxylic acid Traditional Name: 1-methyl-4-(4-pyridylmethylsulfamoyl)pyrrole-2-carboxylic acid Formula: C12H13N3O4S MolecularWeight: 295.31432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)O)S(=O)(=O)NCC2=CC=NC=C2

Isomeric SMILES

CN1C=C(C=C1C(=O)O)S(=O)(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C12H13N3O4S/c1-15-8-10(6-11(15)12(16)17)20(18,19)14-7-9-2-4-13-5-3-9/h2-6,8,14H,7H2,1H3,(H,16,17)