(3R)-3-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium

Systemtic Name: (3R)-3-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium Openeye Name: (3R)-3-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium CAS Name: (3R)-3-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium IUPAC Name: (3R)-3-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium Traditional Name: (3R)-3-piperonylpiperidin-1-ium Formula: C13H18NO2+ MolecularWeight: 220.28752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H17NO2/c1-2-11(8-14-5-1)6-10-3-4-12-13(7-10)16-9-15-12/h3-4,7,11,14H,1-2,5-6,8-9H2/p+1/t11-/m1/s1