(5S)-5-butan-2-yl-3-[3-(1H-imidazol-3-ium-3-yl)propyl]imidazolidine-2,4-dione

Systemtic Name: (5S)-5-butan-2-yl-3-[3-(1H-imidazol-3-ium-3-yl)propyl]imidazolidine-2,4-dione Openeye Name: (5S)-3-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-sec-butyl-imidazolidine-2,4-dione CAS Name: (5S)-5-butan-2-yl-3-[3-(1H-imidazol-3-ium-3-yl)propyl]imidazolidine-2,4-dione IUPAC Name: (5S)-5-butan-2-yl-3-[3-(1H-imidazol-3-ium-3-yl)propyl]imidazolidine-2,4-dione Traditional Name: (5S)-3-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-sec-butyl-hydantoin Formula: C13H21N4O2+ MolecularWeight: 265.33144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)N(C(=O)N1)CCC[N+]2=CNC=C2

Isomeric SMILES

CCC(C)[C@H]1C(=O)N(C(=O)N1)CCC[N+]2=CNC=C2

InChI

InChI=1S/C13H20N4O2/c1-3-10(2)11-12(18)17(13(19)15-11)7-4-6-16-8-5-14-9-16/h5,8-11H,3-4,6-7H2,1-2H3,(H,15,19)/p+1/t10?,11-/m0/s1