2-[2-(2,4-dimethoxyphenyl)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]ethanal bromide

Systemtic Name: 2-[2-(2,4-dimethoxyphenyl)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]ethanal bromide Openeye Name: 2-[2-(2,4-dimethoxyphenyl)-4,5-dihydrothiazol-3-ium-3-yl]acetaldehyde bromide CAS Name: 2-[2-(2,4-dimethoxyphenyl)-4,5-dihydrothiazol-3-ium-3-yl]acetaldehyde bromide IUPAC Name: 2-[2-(2,4-dimethoxyphenyl)-4,5-dihydro-1,3-thiazol-3-ium-3-yl]acetaldehyde bromide Traditional Name: 2-[2-(2,4-dimethoxyphenyl)-2-thiazolin-3-ium-3-yl]acetaldehyde bromide Formula: C13H16BrNO3S MolecularWeight: 346.24004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=[N+](CCS2)CC=O)OC.[Br-]

Isomeric SMILES

COC1=CC(=C(C=C1)C2=[N+](CCS2)CC=O)OC.[Br-]

InChI

InChI=1S/C13H16NO3S.BrH/c1-16-10-3-4-11(12(9-10)17-2)13-14(5-7-15)6-8-18-13;/h3-4,7,9H,5-6,8H2,1-2H3;1H/q+1;/p-1