[(3R)-1-azabicyclo[2.2.2]octan-3-yl] N-[2-(4-fluorophenyl)ethyl]-N-[(3-methylthiophen-2-yl)methyl]carbamate

Systemtic Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] N-[2-(4-fluorophenyl)ethyl]-N-[(3-methylthiophen-2-yl)methyl]carbamate Openeye Name: [(3R)-quinuclidin-3-yl] N-[2-(4-fluorophenyl)ethyl]-N-[(3-methyl-2-thienyl)methyl]carbamate CAS Name: N-[2-(4-fluorophenyl)ethyl]-N-[(3-methyl-2-thiophenyl)methyl]carbamic acid [(3R)-1-azabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] N-[2-(4-fluorophenyl)ethyl]-N-[(3-methylthiophen-2-yl)methyl]carbamate Traditional Name: N-[2-(4-fluorophenyl)ethyl]-N-[(3-methyl-2-thienyl)methyl]carbamic acid [(3R)-quinuclidin-3-yl] ester Formula: C22H27FN2O2S MolecularWeight: 402.525383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CCC2=CC=C(C=C2)F)C(=O)OC3CN4CCC3CC4

Isomeric SMILES

CC1=C(SC=C1)CN(CCC2=CC=C(C=C2)F)C(=O)O[C@H]3CN4CCC3CC4

InChI

InChI=1S/C22H27FN2O2S/c1-16-9-13-28-21(16)15-25(12-6-17-2-4-19(23)5-3-17)22(26)27-20-14-24-10-7-18(20)8-11-24/h2-5,9,13,18,20H,6-8,10-12,14-15H2,1H3/t20-/m0/s1