3-(azetidin-2-ylmethoxy)-5-chloranyl-pyridine; 4-methylbenzenesulfonic acid

Systemtic Name: 3-(azetidin-2-ylmethoxy)-5-chloranyl-pyridine; 4-methylbenzenesulfonic acid Openeye Name: 3-(azetidin-2-ylmethoxy)-5-chloro-pyridine; 4-methylbenzenesulfonic acid CAS Name: 3-(2-azetidinylmethoxy)-5-chloropyridine; 4-methylbenzenesulfonic acid IUPAC Name: 3-(azetidin-2-ylmethoxy)-5-chloropyridine; 4-methylbenzenesulfonic acid Traditional Name: 3-(azetidin-2-ylmethoxy)-5-chloro-pyridine; tosylic acid Formula: C16H19ClN2O4S MolecularWeight: 370.85106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNC1COC2=CC(=CN=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNC1COC2=CC(=CN=C2)Cl

InChI

InChI=1S/C9H11ClN2O.C7H8O3S/c10-7-3-9(5-11-4-7)13-6-8-1-2-12-8;1-6-2-4-7(5-3-6)11(8,9)10/h3-5,8,12H,1-2,6H2;2-5H,1H3,(H,8,9,10)