(3S)-N-[2-(trifluoromethyl)phenyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-[2-(trifluoromethyl)phenyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[2-(trifluoromethyl)phenyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[2-(trifluoromethyl)phenyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-[2-(trifluoromethyl)phenyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[2-(trifluoromethyl)phenyl]piperidin-1-ium-3-carboxamide Formula: C13H16F3N2O+ MolecularWeight: 273.27415

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H15F3N2O/c14-13(15,16)10-5-1-2-6-11(10)18-12(19)9-4-3-7-17-8-9/h1-2,5-6,9,17H,3-4,7-8H2,(H,18,19)/p+1/t9-/m0/s1