(2R)-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-piperidin-1-ium-1-yl-propanamide

Systemtic Name: (2R)-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-piperidin-1-ium-1-yl-propanamide Openeye Name: (2R)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-piperidin-1-ium-1-yl-propanamide CAS Name: (2R)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-(1-piperidin-1-iumyl)propanamide IUPAC Name: (2R)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-piperidin-1-ium-1-ylpropanamide Traditional Name: (2R)-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-piperidin-1-ium-1-yl-propionamide Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)[NH+]3CCCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)NC(=O)N2)[NH+]3CCCCC3

InChI

InChI=1S/C15H20N4O2/c1-10(19-7-3-2-4-8-19)14(20)16-11-5-6-12-13(9-11)18-15(21)17-12/h5-6,9-10H,2-4,7-8H2,1H3,(H,16,20)(H2,17,18,21)/p+1/t10-/m1/s1