1-[(2S)-1-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]amino]propan-2-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2S)-1-oxidanylidene-1-[[4-(trifluoromethyl)phenyl]amino]propan-2-yl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-1-methyl-2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2S)-1-oxo-1-[4-(trifluoromethyl)anilino]propan-2-yl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2S)-1-oxo-1-[4-(trifluoromethyl)anilino]propan-2-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-keto-1-methyl-2-[4-(trifluoromethyl)anilino]ethyl]piperidin-1-ium-4-carboxamide Formula: C16H21F3N3O2+ MolecularWeight: 344.35205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(F)(F)F)[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(F)(F)F)[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C16H20F3N3O2/c1-10(22-8-6-11(7-9-22)14(20)23)15(24)21-13-4-2-12(3-5-13)16(17,18)19/h2-5,10-11H,6-9H2,1H3,(H2,20,23)(H,21,24)/p+1/t10-/m0/s1