5-(4-methoxyphenyl)-2-[1-(oxiran-2-ylmethyl)pyridin-1-ium-4-yl]-1,3-oxazole

Systemtic Name: 5-(4-methoxyphenyl)-2-[1-(oxiran-2-ylmethyl)pyridin-1-ium-4-yl]-1,3-oxazole Openeye Name: 5-(4-methoxyphenyl)-2-[1-(oxiran-2-ylmethyl)pyridin-1-ium-4-yl]oxazole CAS Name: 5-(4-methoxyphenyl)-2-[1-(2-oxiranylmethyl)-4-pyridin-1-iumyl]oxazole IUPAC Name: 5-(4-methoxyphenyl)-2-[1-(oxiran-2-ylmethyl)pyridin-1-ium-4-yl]-1,3-oxazole Traditional Name: 2-(1-glycidylpyridin-1-ium-4-yl)-5-(4-methoxyphenyl)oxazole Formula: C18H17N2O3+ MolecularWeight: 309.33918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=[N+](C=C3)CC4CO4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=[N+](C=C3)CC4CO4

InChI

InChI=1S/C18H17N2O3/c1-21-15-4-2-13(3-5-15)17-10-19-18(23-17)14-6-8-20(9-7-14)11-16-12-22-16/h2-10,16H,11-12H2,1H3/q+1