2-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[(3R)-quinuclidin-1-ium-3-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-[(3R)-quinuclidin-1-ium-3-yl]-3,4-dihydro-1H-isoquinoline Formula: C18H27N2O2+ MolecularWeight: 303.41918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C3C[NH+]4CCC3CC4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)[C@H]3C[NH+]4CCC3CC4)OC

InChI

InChI=1S/C18H26N2O2/c1-21-17-9-14-5-8-20(11-15(14)10-18(17)22-2)16-12-19-6-3-13(16)4-7-19/h9-10,13,16H,3-8,11-12H2,1-2H3/p+1/t16-/m0/s1