3-phenyl-2-[tris(bromanyl)methylsulfonyl]-1H-benzimidazol-3-ium

Systemtic Name: 3-phenyl-2-[tris(bromanyl)methylsulfonyl]-1H-benzimidazol-3-ium Openeye Name: 3-phenyl-2-(tribromomethylsulfonyl)-1H-benzimidazol-3-ium CAS Name: 3-phenyl-2-(tribromomethylsulfonyl)-1H-benzimidazol-3-ium IUPAC Name: 3-phenyl-2-(tribromomethylsulfonyl)-1H-benzimidazol-3-ium Traditional Name: 3-phenyl-2-(tribromomethylsulfonyl)-1H-benzimidazol-3-ium Formula: C14H10Br3N2O2S+ MolecularWeight: 510.0184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(NC3=CC=CC=C32)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(NC3=CC=CC=C32)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C14H9Br3N2O2S/c15-14(16,17)22(20,21)13-18-11-8-4-5-9-12(11)19(13)10-6-2-1-3-7-10/h1-9H/p+1