4,4,5,5-tetramethyl-3-oxidanidyl-2-phenyl-imidazole-1,3-diium 1-oxide

Systemtic Name: 4,4,5,5-tetramethyl-3-oxidanidyl-2-phenyl-imidazole-1,3-diium 1-oxide Openeye Name: 4,4,5,5-tetramethyl-3-oxido-2-phenyl-imidazole-1,3-diium 1-oxide CAS Name: 4,4,5,5-tetramethyl-3-oxido-2-phenylimidazole-1,3-diium 1-oxide IUPAC Name: 4,4,5,5-tetramethyl-3-oxido-2-phenylimidazole-1,3-diium 1-oxide Traditional Name: 4,4,5,5-tetramethyl-3-oxido-2-phenyl-2-imidazoline-1,3-diium 1-oxide Formula: C13H17N2O2+ MolecularWeight: 233.28628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N2O2/c1-12(2)13(3,4)15(17)11(14(12)16)10-8-6-5-7-9-10/h5-9H,1-4H3/q+1