4-[(3-methyl-1,2-oxazol-5-yl)sulfamoyl]-1-propyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-[(3-methyl-1,2-oxazol-5-yl)sulfamoyl]-1-propyl-pyrrole-2-carboxylic acid Openeye Name: 4-[(3-methylisoxazol-5-yl)sulfamoyl]-1-propyl-pyrrole-2-carboxylic acid CAS Name: 4-[(3-methyl-5-isoxazolyl)sulfamoyl]-1-propyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[(3-methyl-1,2-oxazol-5-yl)sulfamoyl]-1-propylpyrrole-2-carboxylic acid Traditional Name: 4-[(3-methylisoxazol-5-yl)sulfamoyl]-1-propyl-pyrrole-2-carboxylic acid Formula: C12H15N3O5S MolecularWeight: 313.3296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)O)S(=O)(=O)NC2=CC(=NO2)C

Isomeric SMILES

CCCN1C=C(C=C1C(=O)O)S(=O)(=O)NC2=CC(=NO2)C

InChI

InChI=1S/C12H15N3O5S/c1-3-4-15-7-9(6-10(15)12(16)17)21(18,19)14-11-5-8(2)13-20-11/h5-7,14H,3-4H2,1-2H3,(H,16,17)