methanesulfonate; 4-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-1,3-oxazole

Systemtic Name: methanesulfonate; 4-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-1,3-oxazole Openeye Name: methanesulfonate; 4-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-oxazole CAS Name: methanesulfonate; 4-(4-methoxyphenyl)-2-(1-pyridin-1-iumyl)oxazole IUPAC Name: methanesulfonate; 4-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-1,3-oxazole Traditional Name: 4-(4-methoxyphenyl)-2-pyridin-1-ium-1-yl-oxazole mesylate Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=COC(=N2)[N+]3=CC=CC=C3.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=COC(=N2)[N+]3=CC=CC=C3.CS(=O)(=O)[O-]

InChI

InChI=1S/C15H13N2O2.CH4O3S/c1-18-13-7-5-12(6-8-13)14-11-19-15(16-14)17-9-3-2-4-10-17;1-5(2,3)4/h2-11H,1H3;1H3,(H,2,3,4)/q+1;/p-1