N-(1,7-dipyridin-3-ylheptan-4-yl)-N-methyl-1-azabicyclo[2.2.2]octane-2-carboxamide

Systemtic Name: N-(1,7-dipyridin-3-ylheptan-4-yl)-N-methyl-1-azabicyclo[2.2.2]octane-2-carboxamide Openeye Name: N-methyl-N-[4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl]quinuclidine-2-carboxamide CAS Name: N-[1,7-bis(3-pyridinyl)heptan-4-yl]-N-methyl-1-azabicyclo[2.2.2]octane-2-carboxamide IUPAC Name: N-(1,7-dipyridin-3-ylheptan-4-yl)-N-methyl-1-azabicyclo[2.2.2]octane-2-carboxamide Traditional Name: N-methyl-N-[4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl]quinuclidine-2-carboxamide Formula: C26H36N4O MolecularWeight: 420.59024

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCCC1=CN=CC=C1)CCCC2=CN=CC=C2)C(=O)C3CC4CCN3CC4

Isomeric SMILES

CN(C(CCCC1=CN=CC=C1)CCCC2=CN=CC=C2)C(=O)C3CC4CCN3CC4

InChI

InChI=1S/C26H36N4O/c1-29(26(31)25-18-21-12-16-30(25)17-13-21)24(10-2-6-22-8-4-14-27-19-22)11-3-7-23-9-5-15-28-20-23/h4-5,8-9,14-15,19-21,24-25H,2-3,6-7,10-13,16-18H2,1H3