5-[[(2S)-azetidin-2-yl]methoxy]-3-ethenyl-2-fluoranyl-pyridine; 4-methylbenzenesulfonic acid

Systemtic Name: 5-[[(2S)-azetidin-2-yl]methoxy]-3-ethenyl-2-fluoranyl-pyridine; 4-methylbenzenesulfonic acid Openeye Name: 5-[[(2S)-azetidin-2-yl]methoxy]-2-fluoro-3-vinyl-pyridine; 4-methylbenzenesulfonic acid CAS Name: 5-[[(2S)-2-azetidinyl]methoxy]-3-ethenyl-2-fluoropyridine; 4-methylbenzenesulfonic acid IUPAC Name: 5-[[(2S)-azetidin-2-yl]methoxy]-3-ethenyl-2-fluoropyridine; 4-methylbenzenesulfonic acid Traditional Name: 5-[[(2S)-azetidin-2-yl]methoxy]-2-fluoro-3-vinyl-pyridine; tosylic acid Formula: C18H21FN2O4S MolecularWeight: 380.433743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C=CC1=CC(=CN=C1F)OCC2CCN2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C=CC1=CC(=CN=C1F)OC[C@@H]2CCN2

InChI

InChI=1S/C11H13FN2O.C7H8O3S/c1-2-8-5-10(6-14-11(8)12)15-7-9-3-4-13-9;1-6-2-4-7(5-3-6)11(8,9)10/h2,5-6,9,13H,1,3-4,7H2;2-5H,1H3,(H,8,9,10)/t9-;/m0./s1