1-azabicyclo[2.2.2]octan-3-yl N-[(2-fluoranyl-5-methoxy-phenyl)methyl]-N-phenyl-carbamate

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl N-[(2-fluoranyl-5-methoxy-phenyl)methyl]-N-phenyl-carbamate Openeye Name: quinuclidin-3-yl N-[(2-fluoro-5-methoxy-phenyl)methyl]-N-phenyl-carbamate CAS Name: N-[(2-fluoro-5-methoxyphenyl)methyl]-N-phenylcarbamic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl N-[(2-fluoro-5-methoxyphenyl)methyl]-N-phenylcarbamate Traditional Name: N-(2-fluoro-5-methoxy-benzyl)-N-phenyl-carbamic acid quinuclidin-3-yl ester Formula: C22H25FN2O3 MolecularWeight: 384.443903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)CN(C2=CC=CC=C2)C(=O)OC3CN4CCC3CC4

Isomeric SMILES

COC1=CC(=C(C=C1)F)CN(C2=CC=CC=C2)C(=O)OC3CN4CCC3CC4

InChI

InChI=1S/C22H25FN2O3/c1-27-19-7-8-20(23)17(13-19)14-25(18-5-3-2-4-6-18)22(26)28-21-15-24-11-9-16(21)10-12-24/h2-8,13,16,21H,9-12,14-15H2,1H3