(2R,4R)-2,4-dimethyl-2-(4-methylphenyl)-1-oxidanidyl-3-oxidanyl-5-thiophen-2-yl-4H-imidazol-1-ium

Systemtic Name: (2R,4R)-2,4-dimethyl-2-(4-methylphenyl)-1-oxidanidyl-3-oxidanyl-5-thiophen-2-yl-4H-imidazol-1-ium Openeye Name: (2R,4R)-3-hydroxy-2,4-dimethyl-1-oxido-2-(p-tolyl)-5-(2-thienyl)-4H-imidazol-1-ium CAS Name: (2R,4R)-3-hydroxy-2,4-dimethyl-2-(4-methylphenyl)-1-oxido-5-thiophen-2-yl-4H-imidazol-1-ium IUPAC Name: (2R,4R)-3-hydroxy-2,4-dimethyl-2-(4-methylphenyl)-1-oxido-5-thiophen-2-yl-4H-imidazol-1-ium Traditional Name: (2R,5R)-1-hydroxy-2,5-dimethyl-3-oxido-2-(p-tolyl)-4-(2-thienyl)-3-imidazolin-3-ium Formula: C16H18N2O2S MolecularWeight: 302.39132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=[N+](C(N1O)(C)C2=CC=C(C=C2)C)[O-])C3=CC=CS3

Isomeric SMILES

C[C@@H]1C(=[N+]([C@](N1O)(C)C2=CC=C(C=C2)C)[O-])C3=CC=CS3

InChI

InChI=1S/C16H18N2O2S/c1-11-6-8-13(9-7-11)16(3)17(19)12(2)15(18(16)20)14-5-4-10-21-14/h4-10,12,19H,1-3H3/t12-,16-/m1/s1