1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(5-methyl-1,3-thiazol-3-ium-3-yl)ethanone

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(5-methyl-1,3-thiazol-3-ium-3-yl)ethanone Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(5-methylthiazol-3-ium-3-yl)ethanone CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(5-methyl-3-thiazol-3-iumyl)ethanone IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(5-methyl-1,3-thiazol-3-ium-3-yl)ethanone Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(5-methylthiazol-3-ium-3-yl)ethanone Formula: C20H28NO2S+ MolecularWeight: 346.50682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CS1)CC(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC1=C[N+](=CS1)CC(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C20H27NO2S/c1-13-10-21(12-24-13)11-17(22)14-8-15(19(2,3)4)18(23)16(9-14)20(5,6)7/h8-10,12H,11H2,1-7H3/p+1