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

Systemtic Name: 4-[1-azabicyclo[2.2.2]octan-3-yl(phenyl)amino]-N,N-diethyl-2-methyl-benzamide Openeye Name: N,N-diethyl-2-methyl-4-(N-quinuclidin-3-ylanilino)benzamide CAS Name: 4-[N-(1-azabicyclo[2.2.2]octan-3-yl)anilino]-N,N-diethyl-2-methylbenzamide IUPAC Name: 4-[N-(1-azabicyclo[2.2.2]octan-3-yl)anilino]-N,N-diethyl-2-methylbenzamide Traditional Name: N,N-diethyl-2-methyl-4-(N-quinuclidin-3-ylanilino)benzamide Formula: C25H33N3O MolecularWeight: 391.54902

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O/c1-4-27(5-2)25(29)23-12-11-22(17-19(23)3)28(21-9-7-6-8-10-21)24-18-26-15-13-20(24)14-16-26/h6-12,17,20,24H,4-5,13-16,18H2,1-3H3