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

Systemtic Name: 7-iodanyl-2-(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)-1-benzofuran-5-carbonitrile Openeye Name: 2-(3-hydroxyquinuclidin-3-yl)-7-iodo-benzofuran-5-carbonitrile CAS Name: 2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)-7-iodo-5-benzofurancarbonitrile IUPAC Name: 2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)-7-iodo-1-benzofuran-5-carbonitrile Traditional Name: 2-(3-hydroxyquinuclidin-3-yl)-7-iodo-benzofuran-5-carbonitrile Formula: C16H15IN2O2 MolecularWeight: 394.20697

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)(C3=CC4=C(O3)C(=CC(=C4)C#N)I)O

Isomeric SMILES

C1CN2CCC1C(C2)(C3=CC4=C(O3)C(=CC(=C4)C#N)I)O

InChI

InChI=1S/C16H15IN2O2/c17-13-6-10(8-18)5-11-7-14(21-15(11)13)16(20)9-19-3-1-12(16)2-4-19/h5-7,12,20H,1-4,9H2