(2S)-1-(6-chloranylpyridin-3-yl)oxypropan-2-amine; 4-methylbenzenesulfonic acid

Systemtic Name: (2S)-1-(6-chloranylpyridin-3-yl)oxypropan-2-amine; 4-methylbenzenesulfonic acid Openeye Name: (2S)-1-[(6-chloro-3-pyridyl)oxy]propan-2-amine; 4-methylbenzenesulfonic acid CAS Name: (2S)-1-[(6-chloro-3-pyridinyl)oxy]-2-propanamine; 4-methylbenzenesulfonic acid IUPAC Name: (2S)-1-(6-chloropyridin-3-yl)oxypropan-2-amine; 4-methylbenzenesulfonic acid Traditional Name: [(1S)-2-[(6-chloro-3-pyridyl)oxy]-1-methyl-ethyl]amine; tosylic acid Formula: C15H19ClN2O4S MolecularWeight: 358.84036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(COC1=CN=C(C=C1)Cl)N

Isomeric SMILES

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

InChI

InChI=1S/C8H11ClN2O.C7H8O3S/c1-6(10)5-12-7-2-3-8(9)11-4-7;1-6-2-4-7(5-3-6)11(8,9)10/h2-4,6H,5,10H2,1H3;2-5H,1H3,(H,8,9,10)/t6-;/m0./s1