4-[[(2S)-1-azoniabicyclo[2.2.2]octan-2-yl]methyl]benzene-1,2-diol

Systemtic Name: 4-[[(2S)-1-azoniabicyclo[2.2.2]octan-2-yl]methyl]benzene-1,2-diol Openeye Name: 4-[[(2S)-quinuclidin-1-ium-2-yl]methyl]benzene-1,2-diol CAS Name: 4-[[(2S)-1-azoniabicyclo[2.2.2]octan-2-yl]methyl]benzene-1,2-diol IUPAC Name: 4-[[(2S)-1-azoniabicyclo[2.2.2]octan-2-yl]methyl]benzene-1,2-diol Traditional Name: 4-[[(2S)-quinuclidin-1-ium-2-yl]methyl]pyrocatechol Formula: C14H20NO2+ MolecularWeight: 234.3141

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1CC2CC3=CC(=C(C=C3)O)O

Isomeric SMILES

C1C[NH+]2CCC1C[C@H]2CC3=CC(=C(C=C3)O)O

InChI

InChI=1S/C14H19NO2/c16-13-2-1-11(9-14(13)17)8-12-7-10-3-5-15(12)6-4-10/h1-2,9-10,12,16-17H,3-8H2/p+1/t12-/m0/s1