(2-methylquinolin-8-yl) 3-sulfamoylbenzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 3-sulfamoylbenzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 3-sulfamoylbenzenesulfonate CAS Name: 3-sulfamoylbenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 3-sulfamoylbenzenesulfonate Traditional Name: 3-sulfamoylbenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C16H14N2O5S2 MolecularWeight: 378.42276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N)C=C1

InChI

InChI=1S/C16H14N2O5S2/c1-11-8-9-12-4-2-7-15(16(12)18-11)23-25(21,22)14-6-3-5-13(10-14)24(17,19)20/h2-10H,1H3,(H2,17,19,20)