[(3R)-1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.2]octan-3-yl] N-phenethyl-N-phenyl-carbamate

Systemtic Name: [(3R)-1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.2]octan-3-yl] N-phenethyl-N-phenyl-carbamate Openeye Name: [(3R)-1-(2-phenoxyethyl)quinuclidin-1-ium-3-yl] N-phenethyl-N-phenyl-carbamate CAS Name: N-phenethyl-N-phenylcarbamic acid [(3R)-1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3R)-1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.2]octan-3-yl] N-phenethyl-N-phenylcarbamate Traditional Name: N-phenethyl-N-phenyl-carbamic acid [(3R)-1-(2-phenoxyethyl)quinuclidin-1-ium-3-yl] ester Formula: C30H35N2O3+ MolecularWeight: 471.6105

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1C(C2)OC(=O)N(CCC3=CC=CC=C3)C4=CC=CC=C4)CCOC5=CC=CC=C5

Isomeric SMILES

C1C[N+]2(CCC1[C@H](C2)OC(=O)N(CCC3=CC=CC=C3)C4=CC=CC=C4)CCOC5=CC=CC=C5

InChI

InChI=1S/C30H35N2O3/c33-30(31(27-12-6-2-7-13-27)19-16-25-10-4-1-5-11-25)35-29-24-32(20-17-26(29)18-21-32)22-23-34-28-14-8-3-9-15-28/h1-15,26,29H,16-24H2/q+1/t26?,29-,32?/m0/s1