(2-methylquinolin-8-yl) 3-fluoranyl-4-methyl-benzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 3-fluoranyl-4-methyl-benzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 3-fluoro-4-methyl-benzenesulfonate CAS Name: 3-fluoro-4-methylbenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 3-fluoro-4-methylbenzenesulfonate Traditional Name: 3-fluoro-4-methyl-benzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C17H14FNO3S MolecularWeight: 331.361363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2N=C(C=C3)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2N=C(C=C3)C)F

InChI

InChI=1S/C17H14FNO3S/c1-11-6-9-14(10-15(11)18)23(20,21)22-16-5-3-4-13-8-7-12(2)19-17(13)16/h3-10H,1-2H3