[(R)-(5-bromanylpyridin-3-yl)-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)methyl]azanium

Systemtic Name: [(R)-(5-bromanylpyridin-3-yl)-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)methyl]azanium Openeye Name: [(R)-(5-bromo-3-pyridyl)-(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]ammonium CAS Name: [(R)-(5-bromo-3-pyridinyl)-(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]ammonium IUPAC Name: [(R)-(5-bromopyridin-3-yl)-(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]azanium Traditional Name: [(R)-(5-bromo-3-pyridyl)-(2-keto-1,3-dihydrobenzimidazol-5-yl)methyl]ammonium Formula: C13H12BrN4O+ MolecularWeight: 320.16458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(C3=CC(=CN=C3)Br)[NH3+])NC(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1[C@H](C3=CC(=CN=C3)Br)[NH3+])NC(=O)N2

InChI

InChI=1S/C13H11BrN4O/c14-9-3-8(5-16-6-9)12(15)7-1-2-10-11(4-7)18-13(19)17-10/h1-6,12H,15H2,(H2,17,18,19)/p+1/t12-/m1/s1