[(1S)-1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S)-1-(2-keto-1,3-dihydrobenzimidazol-5-yl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C16H26N4O+2 MolecularWeight: 290.40384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)NC(=O)N2)[NH2+]CCC[NH+]3CCCC3

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)NC(=O)N2)[NH2+]CCC[NH+]3CCCC3

InChI

InChI=1S/C16H24N4O/c1-12(17-7-4-10-20-8-2-3-9-20)13-5-6-14-15(11-13)19-16(21)18-14/h5-6,11-12,17H,2-4,7-10H2,1H3,(H2,18,19,21)/p+2/t12-/m0/s1