[(2R)-1-oxidanylbutan-2-yl]-[(1R)-1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethyl]azanium

Systemtic Name: [(2R)-1-oxidanylbutan-2-yl]-[(1R)-1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethyl]azanium Openeye Name: [(1R)-1-(hydroxymethyl)propyl]-[(1R)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]ammonium CAS Name: [(2R)-1-hydroxybutan-2-yl]-[(1R)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]ammonium IUPAC Name: [(2R)-1-hydroxybutan-2-yl]-[(1R)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]azanium Traditional Name: [(1R)-1-(2-keto-1,3-dihydrobenzimidazol-5-yl)ethyl]-[(1R)-1-methylolpropyl]ammonium Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]C(C)C1=CC2=C(C=C1)NC(=O)N2

Isomeric SMILES

CC[C@H](CO)[NH2+][C@H](C)C1=CC2=C(C=C1)NC(=O)N2

InChI

InChI=1S/C13H19N3O2/c1-3-10(7-17)14-8(2)9-4-5-11-12(6-9)16-13(18)15-11/h4-6,8,10,14,17H,3,7H2,1-2H3,(H2,15,16,18)/p+1/t8-,10-/m1/s1