4-(dimethoxymethyl)-1-methyl-pyridin-1-ium; 4-methylbenzenesulfonate

Systemtic Name: 4-(dimethoxymethyl)-1-methyl-pyridin-1-ium; 4-methylbenzenesulfonate Openeye Name: 4-(dimethoxymethyl)-1-methyl-pyridin-1-ium; 4-methylbenzenesulfonate CAS Name: 4-(dimethoxymethyl)-1-methylpyridin-1-ium; 4-methylbenzenesulfonate IUPAC Name: 4-(dimethoxymethyl)-1-methylpyridin-1-ium; 4-methylbenzenesulfonate Traditional Name: 4-(dimethoxymethyl)-1-methyl-pyridin-1-ium tosylate Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)C(OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)C(OC)OC

InChI

InChI=1S/C9H14NO2.C7H8O3S/c1-10-6-4-8(5-7-10)9(11-2)12-3;1-6-2-4-7(5-3-6)11(8,9)10/h4-7,9H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1