N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2-diphenylphosphoryl-ethanamide

Systemtic Name: N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2-diphenylphosphoryl-ethanamide Openeye Name: 2-diphenylphosphoryl-N-[(Z)-quinuclidin-3-ylideneamino]acetamide CAS Name: N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2-diphenylphosphorylacetamide IUPAC Name: N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2-diphenylphosphorylacetamide Traditional Name: 2-diphenylphosphoryl-N-[(Z)-quinuclidin-3-ylideneamino]acetamide Formula: C21H24N3O2P MolecularWeight: 381.407921

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(=NNC(=O)CP(=O)(C3=CC=CC=C3)C4=CC=CC=C4)C2

Isomeric SMILES

C1CN2CCC1/C(=N/NC(=O)CP(=O)(C3=CC=CC=C3)C4=CC=CC=C4)/C2

InChI

InChI=1S/C21H24N3O2P/c25-21(23-22-20-15-24-13-11-17(20)12-14-24)16-27(26,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10,17H,11-16H2,(H,23,25)/b22-20+