[(1S,2R)-2-[2-(trifluoromethyl)phenoxy]cycloheptyl]azanium

Systemtic Name: [(1S,2R)-2-[2-(trifluoromethyl)phenoxy]cycloheptyl]azanium Openeye Name: [(1S,2R)-2-[2-(trifluoromethyl)phenoxy]cycloheptyl]ammonium CAS Name: [(1S,2R)-2-[2-(trifluoromethyl)phenoxy]cycloheptyl]ammonium IUPAC Name: [(1S,2R)-2-[2-(trifluoromethyl)phenoxy]cycloheptyl]azanium Traditional Name: [(1S,2R)-2-[2-(trifluoromethyl)phenoxy]cycloheptyl]ammonium Formula: C14H19F3NO+ MolecularWeight: 274.30197

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(CC1)OC2=CC=CC=C2C(F)(F)F)[NH3+]

Isomeric SMILES

C1CC[C@@H]([C@@H](CC1)OC2=CC=CC=C2C(F)(F)F)[NH3+]

InChI

InChI=1S/C14H18F3NO/c15-14(16,17)10-6-4-5-8-12(10)19-13-9-3-1-2-7-11(13)18/h4-6,8,11,13H,1-3,7,9,18H2/p+1/t11-,13+/m0/s1