(3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-amine

Systemtic Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-amine Openeye Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)quinuclidin-1-ium-3-amine CAS Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-amine IUPAC Name: (3S)-N-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-amine Traditional Name: piperonyl-[(3S)-quinuclidin-1-ium-3-yl]amine Formula: C15H21N2O2+ MolecularWeight: 261.33944

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[NH+]2CCC1[C@@H](C2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C15H20N2O2/c1-2-14-15(19-10-18-14)7-11(1)8-16-13-9-17-5-3-12(13)4-6-17/h1-2,7,12-13,16H,3-6,8-10H2/p+1/t13-/m1/s1