1-(2,6-dimethylphenyl)-4-methoxy-pyridin-1-ium; methyl sulfate

Systemtic Name: 1-(2,6-dimethylphenyl)-4-methoxy-pyridin-1-ium; methyl sulfate Openeye Name: 1-(2,6-dimethylphenyl)-4-methoxy-pyridin-1-ium; methyl sulfate CAS Name: 1-(2,6-dimethylphenyl)-4-methoxypyridin-1-ium; methyl sulfate IUPAC Name: 1-(2,6-dimethylphenyl)-4-methoxypyridin-1-ium; methyl sulfate Traditional Name: 1-(2,6-dimethylphenyl)-4-methoxy-pyridin-1-ium; methyl sulfate Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)[N+]2=CC=C(C=C2)OC.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)[N+]2=CC=C(C=C2)OC.COS(=O)(=O)[O-]

InChI

InChI=1S/C14H16NO.CH4O4S/c1-11-5-4-6-12(2)14(11)15-9-7-13(16-3)8-10-15;1-5-6(2,3)4/h4-10H,1-3H3;1H3,(H,2,3,4)/q+1;/p-1