(2S)-1-[6-chloranyl-5-(4-ethenylpyridin-2-yl)pyridin-3-yl]oxypropan-2-amine; 4-methylbenzenesulfonic acid

Systemtic Name: (2S)-1-[6-chloranyl-5-(4-ethenylpyridin-2-yl)pyridin-3-yl]oxypropan-2-amine; 4-methylbenzenesulfonic acid Openeye Name: (2S)-1-[[6-chloro-5-(4-vinyl-2-pyridyl)-3-pyridyl]oxy]propan-2-amine; 4-methylbenzenesulfonic acid CAS Name: (2S)-1-[[6-chloro-5-(4-ethenyl-2-pyridinyl)-3-pyridinyl]oxy]-2-propanamine; 4-methylbenzenesulfonic acid IUPAC Name: (2S)-1-[6-chloro-5-(4-ethenylpyridin-2-yl)pyridin-3-yl]oxypropan-2-amine; 4-methylbenzenesulfonic acid Traditional Name: [(1S)-2-[[6-chloro-5-(4-vinyl-2-pyridyl)-3-pyridyl]oxy]-1-methyl-ethyl]amine; tosylic acid Formula: C22H24ClN3O4S MolecularWeight: 461.96166

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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)C2=NC=CC(=C2)C=C)Cl)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C[C@@H](COC1=CN=C(C(=C1)C2=NC=CC(=C2)C=C)Cl)N

InChI

InChI=1S/C15H16ClN3O.C7H8O3S/c1-3-11-4-5-18-14(6-11)13-7-12(8-19-15(13)16)20-9-10(2)17;1-6-2-4-7(5-3-6)11(8,9)10/h3-8,10H,1,9,17H2,2H3;2-5H,1H3,(H,8,9,10)/t10-;/m0./s1