[(2R,3R)-2-(1-benzofuran-2-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] N-(4-bromophenyl)carbamate

Systemtic Name: [(2R,3R)-2-(1-benzofuran-2-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] N-(4-bromophenyl)carbamate Openeye Name: [(2R,3R)-2-(benzofuran-2-ylmethyl)quinuclidin-3-yl] N-(4-bromophenyl)carbamate CAS Name: N-(4-bromophenyl)carbamic acid [(2R,3R)-2-(2-benzofuranylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(2R,3R)-2-(1-benzofuran-2-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl] N-(4-bromophenyl)carbamate Traditional Name: N-(4-bromophenyl)carbamic acid [(2R,3R)-2-(benzofuran-2-ylmethyl)quinuclidin-3-yl] ester Formula: C23H23BrN2O3 MolecularWeight: 455.34432

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2CC3=CC4=CC=CC=C4O3)OC(=O)NC5=CC=C(C=C5)Br

Isomeric SMILES

C1CN2CCC1[C@H]([C@H]2CC3=CC4=CC=CC=C4O3)OC(=O)NC5=CC=C(C=C5)Br

InChI

InChI=1S/C23H23BrN2O3/c24-17-5-7-18(8-6-17)25-23(27)29-22-15-9-11-26(12-10-15)20(22)14-19-13-16-3-1-2-4-21(16)28-19/h1-8,13,15,20,22H,9-12,14H2,(H,25,27)/t20-,22-/m1/s1