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

Systemtic Name: [(1R)-1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethyl]-[(2S)-pentan-2-yl]azanium Openeye Name: [(1S)-1-methylbutyl]-[(1R)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]ammonium CAS Name: [(1R)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-[(2S)-pentan-2-yl]ammonium IUPAC Name: [(1R)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]-[(2S)-pentan-2-yl]azanium Traditional Name: [(1R)-1-(2-keto-1,3-dihydrobenzimidazol-5-yl)ethyl]-[(1S)-1-methylbutyl]ammonium Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O/c1-4-5-9(2)15-10(3)11-6-7-12-13(8-11)17-14(18)16-12/h6-10,15H,4-5H2,1-3H3,(H2,16,17,18)/p+1/t9-,10+/m0/s1