(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 4-cyanobenzenesulfonate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 4-cyanobenzenesulfonate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-cyanobenzenesulfonate CAS Name: 4-cyanobenzenesulfonic acid (2-oxo-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-cyanobenzenesulfonate Traditional Name: 4-cyanobenzenesulfonic acid (2-keto-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N2O4S/c17-10-11-1-5-14(6-2-11)23(20,21)22-13-4-7-15-12(9-13)3-8-16(19)18-15/h1-2,4-7,9H,3,8H2,(H,18,19)