(2S,5S)-5-ethenyl-2-[(R)-hydroxy(quinolin-4-yl)methyl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1-azabicyclo[2.2.2]octan-1-ium hydrochloride

CAS: 104761-88-8

Formula: C27H29ClF3N2O

SMILES: Cl.O[C@@H]([C@@H]1CC2CC[N+]1(CC1=CC=C(C=C1)C(F)(F)F)C[C@H]2C=C)C1=CC=NC2=CC=CC=C12

IUPAC: (2S,5S)-5-ethenyl-2-[(R)-hydroxy(quinolin-4-yl)methyl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1-azabicyclo[2.2.2]octan-1-ium hydrochloride

InChI: InChI=1S/C27H28F3N2O.ClH/c1-2-19-17-32(16-18-7-9-21(10-8-18)27(28,29)30)14-12-20(19)15-25(32)26(33)23-11-13-31-24-6-4-3-5-22(23)24;/h2-11,13,19-20,25-26,33H,1,12,14-17H2;1H/q+1;/t19-,20?,25+,26-,32?;/m1./s1

Composition: C (66.18%), H (5.97%), Cl (7.23%), F (11.63%), N (5.72%), O (3.27%)

Molar Mass: 489.99

Atom Count: 63

Heavy Atom Count: 34