4,4,4-tris(fluoranyl)-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide

Systemtic Name: 4,4,4-tris(fluoranyl)-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide Openeye Name: 4,4,4-trifluoro-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide CAS Name: 4,4,4-trifluoro-N-methyl-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]butanamide IUPAC Name: 4,4,4-trifluoro-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide Traditional Name: 4,4,4-trifluoro-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butyramide Formula: C18H26F3N2O+ MolecularWeight: 343.40705

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)CCC(F)(F)F

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)CCC(F)(F)F

InChI

InChI=1S/C18H25F3N2O/c1-22(17(24)9-11-18(19,20)21)16-8-5-12-23(14-16)13-10-15-6-3-2-4-7-15/h2-4,6-7,16H,5,8-14H2,1H3/p+1/t16-/m0/s1