5-[[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]amino]-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]amino]-2-methyl-isoindole-1,3-dione Openeye Name: 2-methyl-5-[[(3R)-quinuclidin-1-ium-3-yl]amino]isoindoline-1,3-dione CAS Name: 5-[[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]amino]-2-methylisoindole-1,3-dione IUPAC Name: 5-[[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]amino]-2-methylisoindole-1,3-dione Traditional Name: 2-methyl-5-[[(3R)-quinuclidin-1-ium-3-yl]amino]isoindoline-1,3-quinone Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC3C[NH+]4CCC3CC4

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)N[C@H]3C[NH+]4CCC3CC4

InChI

InChI=1S/C16H19N3O2/c1-18-15(20)12-3-2-11(8-13(12)16(18)21)17-14-9-19-6-4-10(14)5-7-19/h2-3,8,10,14,17H,4-7,9H2,1H3/p+1/t14-/m0/s1