methanesulfonate; 5-[4-(4-methoxyphenyl)phenyl]-2-(1-methylpyridin-1-ium-4-yl)-1,3-oxazole

Systemtic Name: methanesulfonate; 5-[4-(4-methoxyphenyl)phenyl]-2-(1-methylpyridin-1-ium-4-yl)-1,3-oxazole Openeye Name: methanesulfonate; 5-[4-(4-methoxyphenyl)phenyl]-2-(1-methylpyridin-1-ium-4-yl)oxazole CAS Name: methanesulfonate; 5-[4-(4-methoxyphenyl)phenyl]-2-(1-methyl-4-pyridin-1-iumyl)oxazole IUPAC Name: methanesulfonate; 5-[4-(4-methoxyphenyl)phenyl]-2-(1-methylpyridin-1-ium-4-yl)-1,3-oxazole Traditional Name: 5-[4-(4-methoxyphenyl)phenyl]-2-(1-methylpyridin-1-ium-4-yl)oxazole mesylate Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=NC=C(O2)C3=CC=C(C=C3)C4=CC=C(C=C4)OC.CS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=NC=C(O2)C3=CC=C(C=C3)C4=CC=C(C=C4)OC.CS(=O)(=O)[O-]

InChI

InChI=1S/C22H19N2O2.CH4O3S/c1-24-13-11-19(12-14-24)22-23-15-21(26-22)18-5-3-16(4-6-18)17-7-9-20(25-2)10-8-17;1-5(2,3)4/h3-15H,1-2H3;1H3,(H,2,3,4)/q+1;/p-1