(3R)-N-[(1-methylpyrazol-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine

Systemtic Name: (3R)-N-[(1-methylpyrazol-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine Openeye Name: (3R)-N-[(1-methylpyrazol-4-yl)methyl]quinuclidin-1-ium-3-amine CAS Name: (3R)-N-[(1-methyl-4-pyrazolyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine IUPAC Name: (3R)-N-[(1-methylpyrazol-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-3-amine Traditional Name: (1-methylpyrazol-4-yl)methyl-[(3R)-quinuclidin-1-ium-3-yl]amine Formula: C12H21N4+ MolecularWeight: 221.32194

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC2C[NH+]3CCC2CC3

Isomeric SMILES

CN1C=C(C=N1)CN[C@H]2C[NH+]3CCC2CC3

InChI

InChI=1S/C12H20N4/c1-15-8-10(7-14-15)6-13-12-9-16-4-2-11(12)3-5-16/h7-8,11-13H,2-6,9H2,1H3/p+1/t12-/m0/s1