1-methoxypyridin-1-ium; 4-methylbenzenesulfinate

Systemtic Name: 1-methoxypyridin-1-ium; 4-methylbenzenesulfinate Openeye Name: 1-methoxypyridin-1-ium; 4-methylbenzenesulfinate CAS Name: 1-methoxypyridin-1-ium; 4-methylbenzenesulfinate IUPAC Name: 1-methoxypyridin-1-ium; 4-methylbenzenesulfinate Traditional Name: 1-methoxypyridin-1-ium; 4-methylbenzenesulfinate Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O2S.C6H8NO/c1-6-2-4-7(5-3-6)10(8)9;1-8-7-5-3-2-4-6-7/h2-5H,1H3,(H,8,9);2-6H,1H3/q;+1/p-1