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[(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate; [(1S,5R)-8,8-dimethyl-6-oxidanylidene-5-bicyclo[3.2.1]octanyl]methanesulfonic acid

[(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate; [(1S,5R)-8,8-dimethyl-6-oxidanylidene-5-bicyclo[3.2.1]octanyl]methanesulfonic acid

Systemtic Name:[(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate; [(1S,5R)-8,8-dimethyl-6-oxidanylidene-5-bicyclo[3.2.1]octanyl]methanesulfonic acid
Openeye Name:[(1S,5R)-8,8-dimethyl-6-oxo-5-bicyclo[3.2.1]octanyl]methanesulfonic acid; [(3R)-quinuclidin-3-yl] (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate
CAS Name:[(1S,5R)-8,8-dimethyl-6-oxo-5-bicyclo[3.2.1]octanyl]methanesulfonic acid; (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid [(3R)-1-azabicyclo[2.2.2]octan-3-yl] ester
IUPAC Name:[(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate; [(1S,5R)-8,8-dimethyl-6-oxo-5-bicyclo[3.2.1]octanyl]methanesulfonic acid
Traditional Name:[(1S,5R)-6-keto-8,8-dimethyl-5-bicyclo[3.2.1]octanyl]methanesulfonic acid; (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid [(3R)-quinuclidin-3-yl] ester
Formula: C34H44N2O6S
MolecularWeight: 608.78796
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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCCC1(C(=O)C2)CS(=O)(=O)O)C.C1CN2CCC1C(C2)OC(=O)N3CCC4=CC=CC=C4C3C5=CC=CC=C5


Isomeric SMILES

CC1([C@H]2CCC[C@@]1(C(=O)C2)CS(=O)(=O)O)C.C1CN2CCC1[C@H](C2)OC(=O)N3CCC4=CC=CC=C4[C@H]3C5=CC=CC=C5


InChI

InChI=1S/C23H26N2O2.C11H18O4S/c26-23(27-21-16-24-13-10-18(21)11-14-24)25-15-12-17-6-4-5-9-20(17)22(25)19-7-2-1-3-8-19;1-10(2)8-4-3-5-11(10,9(12)6-8)7-16(13,14)15/h1-9,18,21-22H,10-16H2;8H,3-7H2,1-2H3,(H,13,14,15)/t21-,22+;8-,11-/m00/s1


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