5-(azetidin-1-ylmethoxy)-2-chloranyl-pyridine; 4-methylbenzenesulfonic acid

Systemtic Name: 5-(azetidin-1-ylmethoxy)-2-chloranyl-pyridine; 4-methylbenzenesulfonic acid Openeye Name: 5-(azetidin-1-ylmethoxy)-2-chloro-pyridine; 4-methylbenzenesulfonic acid CAS Name: 5-(1-azetidinylmethoxy)-2-chloropyridine; 4-methylbenzenesulfonic acid IUPAC Name: 5-(azetidin-1-ylmethoxy)-2-chloropyridine; 4-methylbenzenesulfonic acid Traditional Name: 5-(azetidin-1-ylmethoxy)-2-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.C1CN(C1)COC2=CN=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(C1)COC2=CN=C(C=C2)Cl

InChI

InChI=1S/C9H11ClN2O.C7H8O3S/c10-9-3-2-8(6-11-9)13-7-12-4-1-5-12;1-6-2-4-7(5-3-6)11(8,9)10/h2-3,6H,1,4-5,7H2;2-5H,1H3,(H,8,9,10)