N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpyridin-1-ium-1-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpyridin-1-ium-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methylpyridin-1-ium-1-yl)acetamide Traditional Name: 2-(4-methylpyridin-1-ium-1-yl)-N-piperonyl-acetamide Formula: C16H17N2O3+ MolecularWeight: 285.31778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=[N+](C=C1)CC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H16N2O3/c1-12-4-6-18(7-5-12)10-16(19)17-9-13-2-3-14-15(8-13)21-11-20-14/h2-8H,9-11H2,1H3/p+1