N-(1-azabicyclo[2.2.2]octan-3-yl)-6-iodanyl-2-phenyl-1,3-benzoxazole-4-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-iodanyl-2-phenyl-1,3-benzoxazole-4-carboxamide Openeye Name: 6-iodo-2-phenyl-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-iodo-2-phenyl-1,3-benzoxazole-4-carboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-iodo-2-phenyl-1,3-benzoxazole-4-carboxamide Traditional Name: 6-iodo-2-phenyl-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide Formula: C21H20IN3O2 MolecularWeight: 473.30687

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC(=CC4=C3N=C(O4)C5=CC=CC=C5)I

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC(=CC4=C3N=C(O4)C5=CC=CC=C5)I

InChI

InChI=1S/C21H20IN3O2/c22-15-10-16(20(26)23-17-12-25-8-6-13(17)7-9-25)19-18(11-15)27-21(24-19)14-4-2-1-3-5-14/h1-5,10-11,13,17H,6-9,12H2,(H,23,26)