4-(1,3-benzodioxol-5-ylmethoxy)pyridin-1-ium-3-amine

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethoxy)pyridin-1-ium-3-amine Openeye Name: 4-(1,3-benzodioxol-5-ylmethoxy)pyridin-1-ium-3-amine CAS Name: 4-(1,3-benzodioxol-5-ylmethoxy)-3-pyridin-1-iumamine IUPAC Name: 4-(1,3-benzodioxol-5-ylmethoxy)pyridin-1-ium-3-amine Traditional Name: (4-piperonyloxypyridin-1-ium-3-yl)amine Formula: C13H13N2O3+ MolecularWeight: 245.25392

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC3=C(C=[NH+]C=C3)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC3=C(C=[NH+]C=C3)N

InChI

InChI=1S/C13H12N2O3/c14-10-6-15-4-3-11(10)16-7-9-1-2-12-13(5-9)18-8-17-12/h1-6H,7-8,14H2/p+1