sodium 4-(2-bromanylethanoylamino)benzenesulfonate

Systemtic Name: sodium 4-(2-bromanylethanoylamino)benzenesulfonate Openeye Name: sodium 4-[(2-bromoacetyl)amino]benzenesulfonate CAS Name: sodium 4-[(2-bromo-1-oxoethyl)amino]benzenesulfonate IUPAC Name: sodium 4-[(2-bromoacetyl)amino]benzenesulfonate Traditional Name: sodium 4-[(2-bromoacetyl)amino]besylate Formula: C8H7BrNNaO4S MolecularWeight: 316.10425

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CBr)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CBr)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C8H8BrNO4S.Na/c9-5-8(11)10-6-1-3-7(4-2-6)15(12,13)14;/h1-4H,5H2,(H,10,11)(H,12,13,14);/q;+1/p-1