2-[(4S)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethylazanium

Systemtic Name: 2-[(4S)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethylazanium Openeye Name: 2-[(4S)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydropyran-4-yl]ethylammonium CAS Name: 2-[(4S)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]-4-oxanyl]ethylammonium IUPAC Name: 2-[(4S)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethylazanium Traditional Name: 2-[(4S)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydropyran-4-yl]ethylammonium Formula: C16H23F3NO+ MolecularWeight: 302.35513

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(CC[NH3+])C2=CC(=CC=C2)C(F)(F)F)C

Isomeric SMILES

CC1(C[C@@](CCO1)(CC[NH3+])C2=CC(=CC=C2)C(F)(F)F)C

InChI

InChI=1S/C16H22F3NO/c1-14(2)11-15(6-8-20,7-9-21-14)12-4-3-5-13(10-12)16(17,18)19/h3-5,10H,6-9,11,20H2,1-2H3/p+1/t15-/m0/s1