1-[(2R,3S)-3-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-bicyclo[2.2.2]octanyl]-N-methyl-methanamine

Systemtic Name: 1-[(2R,3S)-3-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-bicyclo[2.2.2]octanyl]-N-methyl-methanamine Openeye Name: 1-[(2R,3S)-3-[4-chloro-3-(trifluoromethyl)phenyl]-2-bicyclo[2.2.2]octanyl]-N-methyl-methanamine CAS Name: 1-[(2R,3S)-3-[4-chloro-3-(trifluoromethyl)phenyl]-2-bicyclo[2.2.2]octanyl]-N-methylmethanamine IUPAC Name: 1-[(2R,3S)-3-[4-chloro-3-(trifluoromethyl)phenyl]-2-bicyclo[2.2.2]octanyl]-N-methylmethanamine Traditional Name: [(2R,3S)-3-[4-chloro-3-(trifluoromethyl)phenyl]-2-bicyclo[2.2.2]octanyl]methyl-methyl-amine Formula: C17H21ClF3N MolecularWeight: 331.80355

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCC1C2CCC(C1C3=CC(=C(C=C3)Cl)C(F)(F)F)CC2

Isomeric SMILES

CNC[C@H]1[C@H](C2CCC1CC2)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H21ClF3N/c1-22-9-13-10-2-4-11(5-3-10)16(13)12-6-7-15(18)14(8-12)17(19,20)21/h6-8,10-11,13,16,22H,2-5,9H2,1H3/t10?,11?,13-,16-/m1/s1