[(2R)-1,1,1-tris(fluoranyl)-3-piperidin-1-ium-1-yl-propan-2-yl] N-phenylcarbamate

Systemtic Name: [(2R)-1,1,1-tris(fluoranyl)-3-piperidin-1-ium-1-yl-propan-2-yl] N-phenylcarbamate Openeye Name: [(1R)-2,2,2-trifluoro-1-(piperidin-1-ium-1-ylmethyl)ethyl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [(2R)-1,1,1-trifluoro-3-(1-piperidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1,1,1-trifluoro-3-piperidin-1-ium-1-ylpropan-2-yl] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [(1R)-2,2,2-trifluoro-1-(piperidin-1-ium-1-ylmethyl)ethyl] ester Formula: C15H20F3N2O2+ MolecularWeight: 317.32671

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C(F)(F)F)OC(=O)NC2=CC=CC=C2

Isomeric SMILES

C1CC[NH+](CC1)C[C@H](C(F)(F)F)OC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C15H19F3N2O2/c16-15(17,18)13(11-20-9-5-2-6-10-20)22-14(21)19-12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,19,21)/p+1/t13-/m1/s1