N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(3S)-3-(trifluoromethyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide Formula: C15H18F3N4O2+ MolecularWeight: 343.32423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C(F)(F)F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C(F)(F)F

InChI

InChI=1S/C15H17F3N4O2/c16-15(17,18)9-2-1-5-22(7-9)8-13(23)19-10-3-4-11-12(6-10)21-14(24)20-11/h3-4,6,9H,1-2,5,7-8H2,(H,19,23)(H2,20,21,24)/p+1/t9-/m0/s1