2-[2-(1-hydroxyethyl)-4,5-dimethyl-1,3-thiazol-3-ium-3-yl]-1-phenyl-ethanone

Systemtic Name: 2-[2-(1-hydroxyethyl)-4,5-dimethyl-1,3-thiazol-3-ium-3-yl]-1-phenyl-ethanone Openeye Name: 2-[2-(1-hydroxyethyl)-4,5-dimethyl-thiazol-3-ium-3-yl]-1-phenyl-ethanone CAS Name: 2-[2-(1-hydroxyethyl)-4,5-dimethyl-3-thiazol-3-iumyl]-1-phenylethanone IUPAC Name: 2-[2-(1-hydroxyethyl)-4,5-dimethyl-1,3-thiazol-3-ium-3-yl]-1-phenylethanone Traditional Name: 2-[2-(1-hydroxyethyl)-4,5-dimethyl-thiazol-3-ium-3-yl]-1-phenyl-ethanone Formula: C15H18NO2S+ MolecularWeight: 276.37392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=[N+]1CC(=O)C2=CC=CC=C2)C(C)O)C

Isomeric SMILES

CC1=C(SC(=[N+]1CC(=O)C2=CC=CC=C2)C(C)O)C

InChI

InChI=1S/C15H18NO2S/c1-10-12(3)19-15(11(2)17)16(10)9-14(18)13-7-5-4-6-8-13/h4-8,11,17H,9H2,1-3H3/q+1