5-[1-(azetidin-2-yl)pentoxy]-2-fluoranyl-pyridine; 4-methylbenzenesulfonic acid

Systemtic Name: 5-[1-(azetidin-2-yl)pentoxy]-2-fluoranyl-pyridine; 4-methylbenzenesulfonic acid Openeye Name: 5-[1-(azetidin-2-yl)pentoxy]-2-fluoro-pyridine; 4-methylbenzenesulfonic acid CAS Name: 5-[1-(2-azetidinyl)pentoxy]-2-fluoropyridine; 4-methylbenzenesulfonic acid IUPAC Name: 5-[1-(azetidin-2-yl)pentoxy]-2-fluoropyridine; 4-methylbenzenesulfonic acid Traditional Name: 5-[1-(azetidin-2-yl)pentoxy]-2-fluoro-pyridine; tosylic acid Formula: C20H27FN2O4S MolecularWeight: 410.502783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1CCN1)OC2=CN=C(C=C2)F.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCC(C1CCN1)OC2=CN=C(C=C2)F.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C13H19FN2O.C7H8O3S/c1-2-3-4-12(11-7-8-15-11)17-10-5-6-13(14)16-9-10;1-6-2-4-7(5-3-6)11(8,9)10/h5-6,9,11-12,15H,2-4,7-8H2,1H3;2-5H,1H3,(H,8,9,10)