4-[1-azabicyclo[2.2.2]octan-3-yl(phenyl)amino]-N,N-diethyl-2-fluoranyl-benzamide

Systemtic Name: 4-[1-azabicyclo[2.2.2]octan-3-yl(phenyl)amino]-N,N-diethyl-2-fluoranyl-benzamide Openeye Name: N,N-diethyl-2-fluoro-4-(N-quinuclidin-3-ylanilino)benzamide CAS Name: 4-[N-(1-azabicyclo[2.2.2]octan-3-yl)anilino]-N,N-diethyl-2-fluorobenzamide IUPAC Name: 4-[N-(1-azabicyclo[2.2.2]octan-3-yl)anilino]-N,N-diethyl-2-fluorobenzamide Traditional Name: N,N-diethyl-2-fluoro-4-(N-quinuclidin-3-ylanilino)benzamide Formula: C24H30FN3O MolecularWeight: 395.512903

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=C(C=C1)N(C2CN3CCC2CC3)C4=CC=CC=C4)F

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=C(C=C1)N(C2CN3CCC2CC3)C4=CC=CC=C4)F

InChI

InChI=1S/C24H30FN3O/c1-3-27(4-2)24(29)21-11-10-20(16-22(21)25)28(19-8-6-5-7-9-19)23-17-26-14-12-18(23)13-15-26/h5-11,16,18,23H,3-4,12-15,17H2,1-2H3