quinolin-8-yl 3-fluoranyl-4-methyl-benzenesulfonate

Systemtic Name: quinolin-8-yl 3-fluoranyl-4-methyl-benzenesulfonate Openeye Name: 8-quinolyl 3-fluoro-4-methyl-benzenesulfonate CAS Name: 3-fluoro-4-methylbenzenesulfonic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 3-fluoro-4-methylbenzenesulfonate Traditional Name: 3-fluoro-4-methyl-benzenesulfonic acid 8-quinolyl ester Formula: C16H12FNO3S MolecularWeight: 317.334783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12FNO3S/c1-11-7-8-13(10-14(11)17)22(19,20)21-15-6-2-4-12-5-3-9-18-16(12)15/h2-10H,1H3