N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(3-cyanophenyl)-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(3-cyanophenyl)-1-methyl-pyrrole-2-carboxamide Openeye Name: 5-(3-cyanophenyl)-1-methyl-N-quinuclidin-3-yl-pyrrole-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(3-cyanophenyl)-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(3-cyanophenyl)-1-methylpyrrole-2-carboxamide Traditional Name: 5-(3-cyanophenyl)-1-methyl-N-quinuclidin-3-yl-pyrrole-2-carboxamide Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=O)NC2CN3CCC2CC3)C4=CC=CC(=C4)C#N

Isomeric SMILES

CN1C(=CC=C1C(=O)NC2CN3CCC2CC3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H22N4O/c1-23-18(16-4-2-3-14(11-16)12-21)5-6-19(23)20(25)22-17-13-24-9-7-15(17)8-10-24/h2-6,11,15,17H,7-10,13H2,1H3,(H,22,25)