methyl (E,4E)-4-methoxyimino-4-(1-methylpyridin-1-ium-3-yl)but-2-enoate iodide

Systemtic Name: methyl (E,4E)-4-methoxyimino-4-(1-methylpyridin-1-ium-3-yl)but-2-enoate iodide Openeye Name: methyl (E,4E)-4-methoxyimino-4-(1-methylpyridin-1-ium-3-yl)but-2-enoate iodide CAS Name: (E,4E)-4-methoxyimino-4-(1-methyl-3-pyridin-1-iumyl)-2-butenoic acid methyl ester iodide IUPAC Name: methyl (E,4E)-4-methoxyimino-4-(1-methylpyridin-1-ium-3-yl)but-2-enoate iodide Traditional Name: (E,4E)-4-methyloximino-4-(1-methylpyridin-1-ium-3-yl)but-2-enoic acid methyl ester iodide Formula: C12H15IN2O3 MolecularWeight: 362.16357

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C(=NOC)C=CC(=O)OC.[I-]

Isomeric SMILES

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

InChI

InChI=1S/C12H15N2O3.HI/c1-14-8-4-5-10(9-14)11(13-17-3)6-7-12(15)16-2;/h4-9H,1-3H3;1H/q+1;/p-1/b7-6+,13-11+;