(2-fluoranylpyridin-3-yl)methyl 4-ethylbenzenesulfonate

Systemtic Name: (2-fluoranylpyridin-3-yl)methyl 4-ethylbenzenesulfonate Openeye Name: (2-fluoro-3-pyridyl)methyl 4-ethylbenzenesulfonate CAS Name: 4-ethylbenzenesulfonic acid (2-fluoro-3-pyridinyl)methyl ester IUPAC Name: (2-fluoropyridin-3-yl)methyl 4-ethylbenzenesulfonate Traditional Name: 4-ethylbenzenesulfonic acid (2-fluoro-3-pyridyl)methyl ester Formula: C14H14FNO3S MolecularWeight: 295.329263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)OCC2=C(N=CC=C2)F

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)OCC2=C(N=CC=C2)F

InChI

InChI=1S/C14H14FNO3S/c1-2-11-5-7-13(8-6-11)20(17,18)19-10-12-4-3-9-16-14(12)15/h3-9H,2,10H2,1H3