4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-ium Traditional Name: 4-piperonylpiperidin-1-ium Formula: C13H18NO2+ MolecularWeight: 220.28752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1C[NH2+]CCC1CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H17NO2/c1-2-12-13(16-9-15-12)8-11(1)7-10-3-5-14-6-4-10/h1-2,8,10,14H,3-7,9H2/p+1