N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-pyridin-1-ium-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-pyridin-1-ium-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-pyridin-1-ium-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-pyridin-1-iumcarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methylpyridin-1-ium-4-carboxamide Traditional Name: 1-methyl-N-piperonyl-pyridin-1-ium-4-carboxamide Formula: C15H15N2O3+ MolecularWeight: 271.2912

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[N+]1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H14N2O3/c1-17-6-4-12(5-7-17)15(18)16-9-11-2-3-13-14(8-11)20-10-19-13/h2-8H,9-10H2,1H3/p+1