[(Z)-[1-methyl-3-(prop-2-ynoxymethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride

Systemtic Name: [(Z)-[1-methyl-3-(prop-2-ynoxymethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride Openeye Name: [(Z)-[1-methyl-3-(prop-2-ynoxymethyl)imidazol-2-ylidene]methyl]-oxo-ammonium chloride CAS Name: [(Z)-[1-methyl-3-(prop-2-ynoxymethyl)-2-imidazolylidene]methyl]-oxoammonium chloride IUPAC Name: [(Z)-[1-methyl-3-(prop-2-ynoxymethyl)imidazol-2-ylidene]methyl]-oxoazanium chloride Traditional Name: keto-[(Z)-[1-methyl-3-(propargyloxymethyl)-4-imidazolin-2-ylidene]methyl]ammonium chloride Formula: C9H12ClN3O2 MolecularWeight: 229.66348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N3O2.ClH/c1-3-6-14-8-12-5-4-11(2)9(12)7-10-13;/h1,4-5,7H,6,8H2,2H3;1H/b9-7-;