3-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-2-yl]pyridine

Systemtic Name: 3-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-2-yl]pyridine Openeye Name: 3-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-2-yl]pyridine CAS Name: 3-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)-2-piperidin-1-iumyl]pyridine IUPAC Name: 3-[(2S)-1-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium-2-yl]pyridine Traditional Name: 3-[(2S)-1-piperonylpiperidin-1-ium-2-yl]pyridine Formula: C18H21N2O2+ MolecularWeight: 297.37154

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C2=CN=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC[NH+]([C@@H](C1)C2=CN=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H20N2O2/c1-2-9-20(16(5-1)15-4-3-8-19-11-15)12-14-6-7-17-18(10-14)22-13-21-17/h3-4,6-8,10-11,16H,1-2,5,9,12-13H2/p+1/t16-/m0/s1