N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-(4-phenylmethoxyphenoxy)ethanamide

Systemtic Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-(4-phenylmethoxyphenoxy)ethanamide Openeye Name: 2-(4-benzyloxyphenoxy)-N-[(3R)-quinuclidin-1-ium-3-yl]acetamide CAS Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-(4-phenylmethoxyphenoxy)acetamide IUPAC Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-(4-phenylmethoxyphenoxy)acetamide Traditional Name: 2-(4-benzoxyphenoxy)-N-[(3R)-quinuclidin-1-ium-3-yl]acetamide Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)NC(=O)COC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)NC(=O)COC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3/c25-22(23-21-14-24-12-10-18(21)11-13-24)16-27-20-8-6-19(7-9-20)26-15-17-4-2-1-3-5-17/h1-9,18,21H,10-16H2,(H,23,25)/p+1/t21-/m0/s1