methanesulfonate; 5-pyridin-4-yl-1H-indole-2,3-dione

Systemtic Name: methanesulfonate; 5-pyridin-4-yl-1H-indole-2,3-dione Openeye Name: methanesulfonate; 5-(4-pyridyl)indoline-2,3-dione CAS Name: methanesulfonate; 5-pyridin-4-yl-1H-indole-2,3-dione IUPAC Name: methanesulfonate; 5-pyridin-4-yl-1H-indole-2,3-dione Traditional Name: 5-(4-pyridyl)isatin mesylate Formula: C14H11N2O5S- MolecularWeight: 319.31254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CC2=C(C=C1C3=CC=NC=C3)C(=O)C(=O)N2

Isomeric SMILES

CS(=O)(=O)[O-].C1=CC2=C(C=C1C3=CC=NC=C3)C(=O)C(=O)N2

InChI

InChI=1S/C13H8N2O2.CH4O3S/c16-12-10-7-9(8-3-5-14-6-4-8)1-2-11(10)15-13(12)17;1-5(2,3)4/h1-7H,(H,15,16,17);1H3,(H,2,3,4)/p-1