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

Systemtic Name: [(Z)-[1-methyl-3-(3-nitropentoxymethyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride Openeye Name: [(Z)-[1-methyl-3-(3-nitropentoxymethyl)imidazol-2-ylidene]methyl]-oxo-ammonium chloride CAS Name: [(Z)-[1-methyl-3-(3-nitropentoxymethyl)-2-imidazolylidene]methyl]-oxoammonium chloride IUPAC Name: [(Z)-[1-methyl-3-(3-nitropentoxymethyl)imidazol-2-ylidene]methyl]-oxoazanium chloride Traditional Name: keto-[(Z)-[1-methyl-3-(3-nitropentoxymethyl)-4-imidazolin-2-ylidene]methyl]ammonium chloride Formula: C11H19ClN4O4 MolecularWeight: 306.74596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCOCN1C=CN(C1=C[NH+]=O)C)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CCC(CCOCN\1C=CN(/C1=C/[NH+]=O)C)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C11H18N4O4.ClH/c1-3-10(15(17)18)4-7-19-9-14-6-5-13(2)11(14)8-12-16;/h5-6,8,10H,3-4,7,9H2,1-2H3;1H/b11-8-;