1-(1-methylpyridin-1-ium-3-yl)-3-(3-nitrophenyl)prop-2-en-1-one iodide

Systemtic Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(3-nitrophenyl)prop-2-en-1-one iodide Openeye Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(3-nitrophenyl)prop-2-en-1-one iodide CAS Name: 1-(1-methyl-3-pyridin-1-iumyl)-3-(3-nitrophenyl)-2-propen-1-one iodide IUPAC Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(3-nitrophenyl)prop-2-en-1-one iodide Traditional Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(3-nitrophenyl)prop-2-en-1-one iodide Formula: C15H13IN2O3 MolecularWeight: 396.17979

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N2O3.HI/c1-16-9-3-5-13(11-16)15(18)8-7-12-4-2-6-14(10-12)17(19)20;/h2-11H,1H3;1H/q+1;/p-1