2-(2-bromanylprop-2-enylsulfanyl)-6-ethoxy-1H-benzimidazol-3-ium

Systemtic Name: 2-(2-bromanylprop-2-enylsulfanyl)-6-ethoxy-1H-benzimidazol-3-ium Openeye Name: 2-(2-bromoallylsulfanyl)-6-ethoxy-1H-benzimidazol-3-ium CAS Name: 2-(2-bromoprop-2-enylthio)-6-ethoxy-1H-benzimidazol-3-ium IUPAC Name: 2-(2-bromoprop-2-enylsulfanyl)-6-ethoxy-1H-benzimidazol-3-ium Traditional Name: 2-(2-bromoallylthio)-6-ethoxy-1H-benzimidazol-3-ium Formula: C12H14BrN2OS+ MolecularWeight: 314.22136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[NH+]=C(N2)SCC(=C)Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)[NH+]=C(N2)SCC(=C)Br

InChI

InChI=1S/C12H13BrN2OS/c1-3-16-9-4-5-10-11(6-9)15-12(14-10)17-7-8(2)13/h4-6H,2-3,7H2,1H3,(H,14,15)/p+1