5-(4-methoxyphenyl)-2-(1-prop-2-enylpyridin-1-ium-4-yl)-1,3-oxazole perchlorate

Systemtic Name: 5-(4-methoxyphenyl)-2-(1-prop-2-enylpyridin-1-ium-4-yl)-1,3-oxazole perchlorate Openeye Name: 2-(1-allylpyridin-1-ium-4-yl)-5-(4-methoxyphenyl)oxazole perchlorate CAS Name: 5-(4-methoxyphenyl)-2-(1-prop-2-enyl-4-pyridin-1-iumyl)oxazole perchlorate IUPAC Name: 5-(4-methoxyphenyl)-2-(1-prop-2-enylpyridin-1-ium-4-yl)-1,3-oxazole perchlorate Traditional Name: 2-(1-allylpyridin-1-ium-4-yl)-5-(4-methoxyphenyl)oxazole perchlorate Formula: C18H17ClN2O6 MolecularWeight: 392.79038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=[N+](C=C3)CC=C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=[N+](C=C3)CC=C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H17N2O2.ClHO4/c1-3-10-20-11-8-15(9-12-20)18-19-13-17(22-18)14-4-6-16(21-2)7-5-14;2-1(3,4)5/h3-9,11-13H,1,10H2,2H3;(H,2,3,4,5)/q+1;/p-1