1-(4,6-dipropoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane

Systemtic Name: 1-(4,6-dipropoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane Openeye Name: 1-(4,6-dipropoxy-1,3,5-triazin-2-yl)quinuclidin-1-ium CAS Name: 1-(4,6-dipropoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane IUPAC Name: 1-(4,6-dipropoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane Traditional Name: 1-(4,6-dipropoxy-s-triazin-2-yl)quinuclidin-1-ium Formula: C16H27N4O2+ MolecularWeight: 307.41118

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=NC(=N1)[N+]23CCC(CC2)CC3)OCCC

Isomeric SMILES

CCCOC1=NC(=NC(=N1)[N+]23CCC(CC2)CC3)OCCC

InChI

InChI=1S/C16H27N4O2/c1-3-11-21-15-17-14(18-16(19-15)22-12-4-2)20-8-5-13(6-9-20)7-10-20/h13H,3-12H2,1-2H3/q+1