[(Z)-[1-hex-1-ynyl-3-(methoxymethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride

Systemtic Name: [(Z)-[1-hex-1-ynyl-3-(methoxymethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride Openeye Name: [(Z)-[1-hex-1-ynyl-3-(methoxymethyl)imidazol-2-ylidene]methyl]-oxo-ammonium chloride CAS Name: [(Z)-[1-hex-1-ynyl-3-(methoxymethyl)-2-imidazolylidene]methyl]-oxoammonium chloride IUPAC Name: [(Z)-[1-hex-1-ynyl-3-(methoxymethyl)imidazol-2-ylidene]methyl]-oxoazanium chloride Traditional Name: [(Z)-[1-hex-1-ynyl-3-(methoxymethyl)-4-imidazolin-2-ylidene]methyl]-keto-ammonium chloride Formula: C12H18ClN3O2 MolecularWeight: 271.74322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CN1C=CN(C1=C[NH+]=O)COC.[Cl-]

Isomeric SMILES

CCCCC#CN\1C=CN(/C1=C\[NH+]=O)COC.[Cl-]

InChI

InChI=1S/C12H17N3O2.ClH/c1-3-4-5-6-7-14-8-9-15(11-17-2)12(14)10-13-16;/h8-10H,3-5,11H2,1-2H3;1H/b12-10-;