(5-chloranylquinolin-8-yl) 5-fluoranyl-2-methoxy-benzenesulfonate

Systemtic Name: (5-chloranylquinolin-8-yl) 5-fluoranyl-2-methoxy-benzenesulfonate Openeye Name: (5-chloro-8-quinolyl) 5-fluoro-2-methoxy-benzenesulfonate CAS Name: 5-fluoro-2-methoxybenzenesulfonic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 5-fluoro-2-methoxybenzenesulfonate Traditional Name: 5-fluoro-2-methoxy-benzenesulfonic acid (5-chloro-8-quinolyl) ester Formula: C16H11ClFNO4S MolecularWeight: 367.779243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)F)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C16H11ClFNO4S/c1-22-13-6-4-10(18)9-15(13)24(20,21)23-14-7-5-12(17)11-3-2-8-19-16(11)14/h2-9H,1H3