1,2-dimethyl-3-(3-nitrophenyl)sulfonyl-4,5-dihydroimidazol-1-ium iodide

Systemtic Name: 1,2-dimethyl-3-(3-nitrophenyl)sulfonyl-4,5-dihydroimidazol-1-ium iodide Openeye Name: 1,2-dimethyl-3-(3-nitrophenyl)sulfonyl-4,5-dihydroimidazol-1-ium iodide CAS Name: 1,2-dimethyl-3-(3-nitrophenyl)sulfonyl-4,5-dihydroimidazol-1-ium iodide IUPAC Name: 1,2-dimethyl-3-(3-nitrophenyl)sulfonyl-4,5-dihydroimidazol-1-ium iodide Traditional Name: 1,2-dimethyl-3-(3-nitrophenyl)sulfonyl-2-imidazolin-1-ium iodide Formula: C11H14IN3O4S MolecularWeight: 411.21603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](CCN1S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C.[I-]

Isomeric SMILES

CC1=[N+](CCN1S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C.[I-]

InChI

InChI=1S/C11H14N3O4S.HI/c1-9-12(2)6-7-13(9)19(17,18)11-5-3-4-10(8-11)14(15)16;/h3-5,8H,6-7H2,1-2H3;1H/q+1;/p-1