2-[2-(2,4-dimethoxyphenyl)-3-methyl-imidazol-3-ium-1-yl]ethanal bromide

Systemtic Name: 2-[2-(2,4-dimethoxyphenyl)-3-methyl-imidazol-3-ium-1-yl]ethanal bromide Openeye Name: 2-[2-(2,4-dimethoxyphenyl)-3-methyl-imidazol-3-ium-1-yl]acetaldehyde bromide CAS Name: 2-[2-(2,4-dimethoxyphenyl)-3-methyl-1-imidazol-3-iumyl]acetaldehyde bromide IUPAC Name: 2-[2-(2,4-dimethoxyphenyl)-3-methylimidazol-3-ium-1-yl]acetaldehyde bromide Traditional Name: 2-[2-(2,4-dimethoxyphenyl)-3-methyl-imidazol-3-ium-1-yl]acetaldehyde bromide Formula: C14H17BrN2O3 MolecularWeight: 341.20038

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C=C1)CC=O)C2=C(C=C(C=C2)OC)OC.[Br-]

Isomeric SMILES

C[N+]1=C(N(C=C1)CC=O)C2=C(C=C(C=C2)OC)OC.[Br-]

InChI

InChI=1S/C14H17N2O3.BrH/c1-15-6-7-16(8-9-17)14(15)12-5-4-11(18-2)10-13(12)19-3;/h4-7,9-10H,8H2,1-3H3;1H/q+1;/p-1