[(Z)-(1-methylpyridin-2-ylidene)methyl]-oxidanylidene-azanium; phenyl 1-methylpyridin-1-ium-3-carboxylate; diiodide

Systemtic Name: [(Z)-(1-methylpyridin-2-ylidene)methyl]-oxidanylidene-azanium; phenyl 1-methylpyridin-1-ium-3-carboxylate; diiodide Openeye Name: [(Z)-(1-methyl-2-pyridylidene)methyl]-oxo-ammonium; phenyl 1-methylpyridin-1-ium-3-carboxylate; diiodide CAS Name: 1-methyl-3-pyridin-1-iumcarboxylic acid phenyl ester; [(Z)-(1-methyl-2-pyridinylidene)methyl]-oxoammonium; diiodide IUPAC Name: [(Z)-(1-methylpyridin-2-ylidene)methyl]-oxoazanium; phenyl 1-methylpyridin-1-ium-3-carboxylate; diiodide Traditional Name: keto-[(Z)-(1-methyl-2-pyridylidene)methyl]ammonium; 1-methylpyridin-1-ium-3-carboxylic acid phenyl ester; diiodide Formula: C20H21I2N3O3 MolecularWeight: 605.20798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=CC1=C[NH+]=O.C[N+]1=CC=CC(=C1)C(=O)OC2=CC=CC=C2.[I-].[I-]

Isomeric SMILES

CN\1C=CC=C/C1=C/[NH+]=O.C[N+]1=CC=CC(=C1)C(=O)OC2=CC=CC=C2.[I-].[I-]

InChI

InChI=1S/C13H12NO2.C7H8N2O.2HI/c1-14-9-5-6-11(10-14)13(15)16-12-7-3-2-4-8-12;1-9-5-3-2-4-7(9)6-8-10;;/h2-10H,1H3;2-6H,1H3;2*1H/q+1;;;/p-1/b;7-6-;;