3-(azetidin-2-ylmethoxy)-2-fluoranyl-6-methyl-pyridine; 4-methylbenzenesulfonic acid

Systemtic Name: 3-(azetidin-2-ylmethoxy)-2-fluoranyl-6-methyl-pyridine; 4-methylbenzenesulfonic acid Openeye Name: 3-(azetidin-2-ylmethoxy)-2-fluoro-6-methyl-pyridine; 4-methylbenzenesulfonic acid CAS Name: 3-(2-azetidinylmethoxy)-2-fluoro-6-methylpyridine; 4-methylbenzenesulfonic acid IUPAC Name: 3-(azetidin-2-ylmethoxy)-2-fluoro-6-methylpyridine; 4-methylbenzenesulfonic acid Traditional Name: 3-(azetidin-2-ylmethoxy)-2-fluoro-6-methyl-pyridine; tosylic acid Formula: C17H21FN2O4S MolecularWeight: 368.423043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=NC(=C(C=C1)OCC2CCN2)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=NC(=C(C=C1)OCC2CCN2)F

InChI

InChI=1S/C10H13FN2O.C7H8O3S/c1-7-2-3-9(10(11)13-7)14-6-8-4-5-12-8;1-6-2-4-7(5-3-6)11(8,9)10/h2-3,8,12H,4-6H2,1H3;2-5H,1H3,(H,8,9,10)