1-methoxy-N,N-dimethyl-pyridin-1-ium-4-amine; 4-methylbenzenesulfonate

Systemtic Name: 1-methoxy-N,N-dimethyl-pyridin-1-ium-4-amine; 4-methylbenzenesulfonate Openeye Name: 1-methoxy-N,N-dimethyl-pyridin-1-ium-4-amine; 4-methylbenzenesulfonate CAS Name: 1-methoxy-N,N-dimethyl-4-pyridin-1-iumamine; 4-methylbenzenesulfonate IUPAC Name: 1-methoxy-N,N-dimethylpyridin-1-ium-4-amine; 4-methylbenzenesulfonate Traditional Name: (1-methoxypyridin-1-ium-4-yl)-dimethyl-amine tosylate Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN(C)C1=CC=[N+](C=C1)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN(C)C1=CC=[N+](C=C1)OC

InChI

InChI=1S/C8H13N2O.C7H8O3S/c1-9(2)8-4-6-10(11-3)7-5-8;1-6-2-4-7(5-3-6)11(8,9)10/h4-7H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1