2-(3-methyl-1,3-thiazolidin-3-ium-3-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(3-methyl-1,3-thiazolidin-3-ium-3-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(3-methylthiazolidin-3-ium-3-yl)-1-phenyl-ethanone bromide CAS Name: 2-(3-methyl-3-thiazolidin-3-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(3-methyl-1,3-thiazolidin-3-ium-3-yl)-1-phenylethanone bromide Traditional Name: 2-(3-methylthiazolidin-3-ium-3-yl)-1-phenyl-ethanone bromide Formula: C12H16BrNOS MolecularWeight: 302.23054

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCSC1)CC(=O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

C[N+]1(CCSC1)CC(=O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C12H16NOS.BrH/c1-13(7-8-15-10-13)9-12(14)11-5-3-2-4-6-11;/h2-6H,7-10H2,1H3;1H/q+1;/p-1