N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(4-cyanophenyl)-1H-pyrrole-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(4-cyanophenyl)-1H-pyrrole-2-carboxamide Openeye Name: 5-(4-cyanophenyl)-N-quinuclidin-3-yl-1H-pyrrole-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(4-cyanophenyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(4-cyanophenyl)-1H-pyrrole-2-carboxamide Traditional Name: 5-(4-cyanophenyl)-N-quinuclidin-3-yl-1H-pyrrole-2-carboxamide Formula: C19H20N4O MolecularWeight: 320.3883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC=C(N3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC=C(N3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C19H20N4O/c20-11-13-1-3-14(4-2-13)16-5-6-17(21-16)19(24)22-18-12-23-9-7-15(18)8-10-23/h1-6,15,18,21H,7-10,12H2,(H,22,24)