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

Systemtic Name: (3-ethanoylphenyl) 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonate Openeye Name: (3-acetylphenyl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate CAS Name: 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate Traditional Name: 2-keto-3,4-dihydro-1H-quinoline-6-sulfonic acid (3-acetylphenyl) ester Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C17H15NO5S/c1-11(19)12-3-2-4-14(9-12)23-24(21,22)15-6-7-16-13(10-15)5-8-17(20)18-16/h2-4,6-7,9-10H,5,8H2,1H3,(H,18,20)