N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-pent-1-ynyl-1H-indazole-3-carboxamide

Systemtic Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-pent-1-ynyl-1H-indazole-3-carboxamide Openeye Name: 6-pent-1-ynyl-N-[(3R)-quinuclidin-3-yl]-1H-indazole-3-carboxamide CAS Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-pent-1-ynyl-1H-indazole-3-carboxamide IUPAC Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-pent-1-ynyl-1H-indazole-3-carboxamide Traditional Name: 6-pent-1-ynyl-N-[(3R)-quinuclidin-3-yl]-1H-indazole-3-carboxamide Formula: C20H24N4O MolecularWeight: 336.43076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=CC2=C(C=C1)C(=NN2)C(=O)NC3CN4CCC3CC4

Isomeric SMILES

CCCC#CC1=CC2=C(C=C1)C(=NN2)C(=O)N[C@H]3CN4CCC3CC4

InChI

InChI=1S/C20H24N4O/c1-2-3-4-5-14-6-7-16-17(12-14)22-23-19(16)20(25)21-18-13-24-10-8-15(18)9-11-24/h6-7,12,15,18H,2-3,8-11,13H2,1H3,(H,21,25)(H,22,23)/t18-/m0/s1