[(Z)-[1-ethyl-3-(3-methylsulfonylbutan-2-yloxymethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride

Systemtic Name: [(Z)-[1-ethyl-3-(3-methylsulfonylbutan-2-yloxymethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride Openeye Name: [(Z)-[1-ethyl-3-[(1-methyl-2-methylsulfonyl-propoxy)methyl]imidazol-2-ylidene]methyl]-oxo-ammonium chloride CAS Name: [(Z)-[1-ethyl-3-(3-methylsulfonylbutan-2-yloxymethyl)-2-imidazolylidene]methyl]-oxoammonium chloride IUPAC Name: [(Z)-[1-ethyl-3-(3-methylsulfonylbutan-2-yloxymethyl)imidazol-2-ylidene]methyl]-oxoazanium chloride Traditional Name: [(Z)-[1-ethyl-3-[(2-mesyl-1-methyl-propoxy)methyl]-4-imidazolin-2-ylidene]methyl]-keto-ammonium chloride Formula: C12H22ClN3O4S MolecularWeight: 339.83878

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN(C1=C[NH+]=O)COC(C)C(C)S(=O)(=O)C.[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C12H21N3O4S.ClH/c1-5-14-6-7-15(12(14)8-13-16)9-19-10(2)11(3)20(4,17)18;/h6-8,10-11H,5,9H2,1-4H3;1H/b12-8-;