(3R)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine

Systemtic Name: (3R)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine Openeye Name: (3R)-N-[(4-benzyloxy-3-methoxy-phenyl)methyl]quinuclidin-1-ium-3-amine CAS Name: (3R)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine IUPAC Name: (3R)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine Traditional Name: (4-benzoxy-3-methoxy-benzyl)-[(3R)-quinuclidin-1-ium-3-yl]amine Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2C[NH+]3CCC2CC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CN[C@H]2C[NH+]3CCC2CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H28N2O2/c1-25-22-13-18(14-23-20-15-24-11-9-19(20)10-12-24)7-8-21(22)26-16-17-5-3-2-4-6-17/h2-8,13,19-20,23H,9-12,14-16H2,1H3/p+1/t20-/m0/s1