(3S)-3-[[3-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium

Systemtic Name: (3S)-3-[[3-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium Openeye Name: (3S)-3-[[3-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium CAS Name: (3S)-3-[[3-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium IUPAC Name: (3S)-3-[[3-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium Traditional Name: (3S)-3-[[3-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium Formula: C13H17F3NO+ MolecularWeight: 260.27539

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)COC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)COC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C13H16F3NO/c14-13(15,16)11-4-1-5-12(7-11)18-9-10-3-2-6-17-8-10/h1,4-5,7,10,17H,2-3,6,8-9H2/p+1/t10-/m0/s1