N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-3-yl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-3-yl-1H-pyrrole-2-carboxamide Openeye Name: N-[(2S,3R)-2-methylquinuclidin-3-yl]-5-(3-pyridyl)-1H-pyrrole-2-carboxamide CAS Name: N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-5-(3-pyridinyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-3-yl-1H-pyrrole-2-carboxamide Traditional Name: N-[(2S,3R)-2-methylquinuclidin-3-yl]-5-(3-pyridyl)-1H-pyrrole-2-carboxamide Formula: C18H22N4O MolecularWeight: 310.39348

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(N3)C4=CN=CC=C4

Isomeric SMILES

C[C@H]1[C@@H](C2CCN1CC2)NC(=O)C3=CC=C(N3)C4=CN=CC=C4

InChI

InChI=1S/C18H22N4O/c1-12-17(13-6-9-22(12)10-7-13)21-18(23)16-5-4-15(20-16)14-3-2-8-19-11-14/h2-5,8,11-13,17,20H,6-7,9-10H2,1H3,(H,21,23)/t12-,17-/m0/s1