4-(2-carboxyethylcarbamoyl)benzenediazonium; methanesulfonate

Systemtic Name: 4-(2-carboxyethylcarbamoyl)benzenediazonium; methanesulfonate Openeye Name: 4-(2-carboxyethylcarbamoyl)benzenediazonium; methanesulfonate CAS Name: 4-[(2-carboxyethylamino)-oxomethyl]benzenediazonium; methanesulfonate IUPAC Name: 4-(2-carboxyethylcarbamoyl)benzenediazonium; methanesulfonate Traditional Name: 4-(2-carboxyethylcarbamoyl)benzenediazonium mesylate Formula: C11H13N3O6S MolecularWeight: 315.30242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CC(=CC=C1C(=O)NCCC(=O)O)[N+]#N

Isomeric SMILES

CS(=O)(=O)[O-].C1=CC(=CC=C1C(=O)NCCC(=O)O)[N+]#N

InChI

InChI=1S/C10H9N3O3.CH4O3S/c11-13-8-3-1-7(2-4-8)10(16)12-6-5-9(14)15;1-5(2,3)4/h1-4H,5-6H2,(H-,12,14,15,16);1H3,(H,2,3,4)