N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methyl-pyridin-1-ium-4-carboxamide iodide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methyl-pyridin-1-ium-4-carboxamide iodide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-1-methyl-pyridin-1-ium-4-carboxamide iodide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methyl-4-pyridin-1-iumcarboxamide iodide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-methylpyridin-1-ium-4-carboxamide iodide Traditional Name: 1-methyl-N-[(E)-piperonylideneamino]pyridin-1-ium-4-carboxamide iodide Formula: C15H14IN3O3 MolecularWeight: 411.19443

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(=O)NN=CC2=CC3=C(C=C2)OCO3.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C(=O)N/N=C/C2=CC3=C(C=C2)OCO3.[I-]

InChI

InChI=1S/C15H13N3O3.HI/c1-18-6-4-12(5-7-18)15(19)17-16-9-11-2-3-13-14(8-11)21-10-20-13;/h2-9H,10H2,1H3;1H