2-[(4R)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethyl-ethyl-azanium

Systemtic Name: 2-[(4R)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethyl-ethyl-azanium Openeye Name: 2-[(4R)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydropyran-4-yl]ethyl-ethyl-ammonium CAS Name: 2-[(4R)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]-4-oxanyl]ethyl-ethylammonium IUPAC Name: 2-[(4R)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]oxan-4-yl]ethyl-ethylazanium Traditional Name: 2-[(4R)-2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydropyran-4-yl]ethyl-ethyl-ammonium Formula: C18H27F3NO+ MolecularWeight: 330.40829

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CCC1(CCOC(C1)(C)C)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC[NH2+]CC[C@]1(CCOC(C1)(C)C)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C18H26F3NO/c1-4-22-10-8-17(9-11-23-16(2,3)13-17)14-6-5-7-15(12-14)18(19,20)21/h5-7,12,22H,4,8-11,13H2,1-3H3/p+1/t17-/m1/s1