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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-iodanyl-5-nitro-benzamide Openeye Name: 2-iodo-5-nitro-N-quinuclidin-3-yl-benzamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-iodo-5-nitrobenzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-iodo-5-nitrobenzamide Traditional Name: 2-iodo-5-nitro-N-quinuclidin-3-yl-benzamide Formula: C14H16IN3O3 MolecularWeight: 401.19961

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])I

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])I

InChI

InChI=1S/C14H16IN3O3/c15-12-2-1-10(18(20)21)7-11(12)14(19)16-13-8-17-5-3-9(13)4-6-17/h1-2,7,9,13H,3-6,8H2,(H,16,19)