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O-(4-Chlorobenzoyl)hydroquinine
Hydroquinine 4-chlorobenzoate, (1R)-((1S,4S,5R)-5-ethylquinuclidin-2-yl)(6-methoxyquinolin-4-yl)methyl 4-chlorobenzoate, O-(4-chlorobenzoyl)-hydroquinine, Dihydroquinine 4-chlorobenzoate, 10,11-dihydroquinine p-chlorobenzoate, MFCD00161486
CAS Number: 113216-88-9
IUPAC name: [(R)-[(2S,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methyl] 4-chlorobenzoate
Molecular formula: C27H29ClN2O3
Molecular weight: 464.98400
InChI: InChI=1S/C27H29ClN2O3/c1-3-17-16-30-13-11-19(17)14-25(30)26(33-27(31)18-4-6-20(28)7-5-18)22-10-12-29-24-9-8-21(32-2)15-23(22)24/h4-10,12,15,17,19,25-26H,3,11,13-14,16H2,1-2H3/t17-,19-,25-,26+/m0/s1
InChIKey: TXVNNFDXQZFMBQ-MFQNCIFPSA-N
SMILES: CC[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](C3=C4C=C(C=CC4=NC=C3)OC)OC(=O)C5=CC=C(C=C5)Cl
EINECS: -
