[(3R)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3R)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-3-yl]methanol Openeye Name: [(3R)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3R)-1-(1,3-benzodioxol-5-ylmethyl)-3-piperidin-1-iumyl]methanol IUPAC Name: [(3R)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-3-yl]methanol Traditional Name: [(3R)-1-piperonylpiperidin-1-ium-3-yl]methanol Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c16-9-12-2-1-5-15(8-12)7-11-3-4-13-14(6-11)18-10-17-13/h3-4,6,12,16H,1-2,5,7-10H2/p+1/t12-/m1/s1