[(Z)-[1-methyl-3-(phenylmethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium iodide

Systemtic Name: [(Z)-[1-methyl-3-(phenylmethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium iodide Openeye Name: [(Z)-(1-benzyl-3-methyl-imidazol-2-ylidene)methyl]-oxo-ammonium iodide CAS Name: [(Z)-[1-methyl-3-(phenylmethyl)-2-imidazolylidene]methyl]-oxoammonium iodide IUPAC Name: [(Z)-(1-benzyl-3-methylimidazol-2-ylidene)methyl]-oxoazanium iodide Traditional Name: [(Z)-(1-benzyl-3-methyl-4-imidazolin-2-ylidene)methyl]-keto-ammonium iodide Formula: C12H14IN3O MolecularWeight: 343.16353

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN(C1=C[NH+]=O)CC2=CC=CC=C2.[I-]

Isomeric SMILES

CN\1C=CN(/C1=C\[NH+]=O)CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C12H13N3O.HI/c1-14-7-8-15(12(14)9-13-16)10-11-5-3-2-4-6-11;/h2-9H,10H2,1H3;1H/b12-9-;