(2-acetamidophenyl) 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonate

Systemtic Name: (2-acetamidophenyl) 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonate Openeye Name: (2-acetamidophenyl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate CAS Name: 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate Traditional Name: 2-keto-3,4-dihydro-1H-quinoline-6-sulfonic acid (2-acetamidophenyl) ester Formula: C17H16N2O5S MolecularWeight: 360.38434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C17H16N2O5S/c1-11(20)18-15-4-2-3-5-16(15)24-25(22,23)13-7-8-14-12(10-13)6-9-17(21)19-14/h2-5,7-8,10H,6,9H2,1H3,(H,18,20)(H,19,21)