1-[5-(4-bromophenyl)-2,4,4-trimethyl-1-oxidanidyl-3-oxidanyl-imidazol-1-ium-2-yl]ethanone

Systemtic Name: 1-[5-(4-bromophenyl)-2,4,4-trimethyl-1-oxidanidyl-3-oxidanyl-imidazol-1-ium-2-yl]ethanone Openeye Name: 1-[5-(4-bromophenyl)-3-hydroxy-2,4,4-trimethyl-1-oxido-imidazol-1-ium-2-yl]ethanone CAS Name: 1-[5-(4-bromophenyl)-3-hydroxy-2,4,4-trimethyl-1-oxido-2-imidazol-1-iumyl]ethanone IUPAC Name: 1-[5-(4-bromophenyl)-3-hydroxy-2,4,4-trimethyl-1-oxidoimidazol-1-ium-2-yl]ethanone Traditional Name: 1-[5-(4-bromophenyl)-3-hydroxy-2,4,4-trimethyl-1-oxido-3-imidazolin-1-ium-2-yl]ethanone Formula: C14H17BrN2O3 MolecularWeight: 341.20038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrN2O3/c1-9(18)14(4)16(19)12(13(2,3)17(14)20)10-5-7-11(15)8-6-10/h5-8,20H,1-4H3