7-iodanyl-2-(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)-1-benzofuran-5-carbaldehyde

Systemtic Name: 7-iodanyl-2-(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)-1-benzofuran-5-carbaldehyde Openeye Name: 2-(3-hydroxyquinuclidin-3-yl)-7-iodo-benzofuran-5-carbaldehyde CAS Name: 2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)-7-iodo-5-benzofurancarboxaldehyde IUPAC Name: 2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)-7-iodo-1-benzofuran-5-carbaldehyde Traditional Name: 2-(3-hydroxyquinuclidin-3-yl)-7-iodo-benzofuran-5-carbaldehyde Formula: C16H16INO3 MolecularWeight: 397.20761

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)(C3=CC4=CC(=CC(=C4O3)I)C=O)O

Isomeric SMILES

C1CN2CCC1C(C2)(C3=CC4=CC(=CC(=C4O3)I)C=O)O

InChI

InChI=1S/C16H16INO3/c17-13-6-10(8-19)5-11-7-14(21-15(11)13)16(20)9-18-3-1-12(16)2-4-18/h5-8,12,20H,1-4,9H2