[(E)-[1-(but-3-ynoxymethyl)-3-methyl-imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride

Systemtic Name: [(E)-[1-(but-3-ynoxymethyl)-3-methyl-imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride Openeye Name: [(E)-[1-(but-3-ynoxymethyl)-3-methyl-imidazol-2-ylidene]methyl]-oxo-ammonium chloride CAS Name: [(E)-[1-(but-3-ynoxymethyl)-3-methyl-2-imidazolylidene]methyl]-oxoammonium chloride IUPAC Name: [(E)-[1-(but-3-ynoxymethyl)-3-methylimidazol-2-ylidene]methyl]-oxoazanium chloride Traditional Name: [(E)-[1-(but-3-ynoxymethyl)-3-methyl-4-imidazolin-2-ylidene]methyl]-keto-ammonium chloride Formula: C10H14ClN3O2 MolecularWeight: 243.69006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O2.ClH/c1-3-4-7-15-9-13-6-5-12(2)10(13)8-11-14;/h1,5-6,8H,4,7,9H2,2H3;1H/b10-8+;