N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-5-iodanyl-2,3-dimethoxy-benzamide

Systemtic Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-5-iodanyl-2,3-dimethoxy-benzamide Openeye Name: 5-iodanyl-2,3-dimethoxy-N-[(3S)-quinuclidin-3-yl]benzamide CAS Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-5-iodanyl-2,3-dimethoxybenzamide IUPAC Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-5-iodanyl-2,3-dimethoxybenzamide Traditional Name: 5-iodanyl-2,3-dimethoxy-N-[(3S)-quinuclidin-3-yl]benzamide Formula: C16H21IN2O3 MolecularWeight: 414.254164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)I)C(=O)NC2CN3CCC2CC3)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)[125I])C(=O)N[C@@H]2CN3CCC2CC3)OC

InChI

InChI=1S/C16H21IN2O3/c1-21-14-8-11(17)7-12(15(14)22-2)16(20)18-13-9-19-5-3-10(13)4-6-19/h7-8,10,13H,3-6,9H2,1-2H3,(H,18,20)/t13-/m1/s1/i17-2