(2S)-1-(6-fluoranylpyridin-3-yl)oxy-N-methyl-butan-2-amine; 4-methylbenzenesulfonic acid

Systemtic Name: (2S)-1-(6-fluoranylpyridin-3-yl)oxy-N-methyl-butan-2-amine; 4-methylbenzenesulfonic acid Openeye Name: (2S)-1-[(6-fluoro-3-pyridyl)oxy]-N-methyl-butan-2-amine; 4-methylbenzenesulfonic acid CAS Name: (2S)-1-[(6-fluoro-3-pyridinyl)oxy]-N-methyl-2-butanamine; 4-methylbenzenesulfonic acid IUPAC Name: (2S)-1-(6-fluoropyridin-3-yl)oxy-N-methylbutan-2-amine; 4-methylbenzenesulfonic acid Traditional Name: [(1S)-1-[(6-fluoro-3-pyridyl)oxymethyl]propyl]-methyl-amine; tosylic acid Formula: C17H23FN2O4S MolecularWeight: 370.438923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CN=C(C=C1)F)NC.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC[C@@H](COC1=CN=C(C=C1)F)NC.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C10H15FN2O.C7H8O3S/c1-3-8(12-2)7-14-9-4-5-10(11)13-6-9;1-6-2-4-7(5-3-6)11(8,9)10/h4-6,8,12H,3,7H2,1-2H3;2-5H,1H3,(H,8,9,10)/t8-;/m0./s1