[(Z)-[1-ethyl-3-(4-methyl-4-nitro-pentyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride

Systemtic Name: [(Z)-[1-ethyl-3-(4-methyl-4-nitro-pentyl)imidazol-2-ylidene]methyl]-oxidanylidene-azanium chloride Openeye Name: [(Z)-[1-ethyl-3-(4-methyl-4-nitro-pentyl)imidazol-2-ylidene]methyl]-oxo-ammonium chloride CAS Name: [(Z)-[1-ethyl-3-(4-methyl-4-nitropentyl)-2-imidazolylidene]methyl]-oxoammonium chloride IUPAC Name: [(Z)-[1-ethyl-3-(4-methyl-4-nitropentyl)imidazol-2-ylidene]methyl]-oxoazanium chloride Traditional Name: [(Z)-[1-ethyl-3-(4-methyl-4-nitro-pentyl)-4-imidazolin-2-ylidene]methyl]-keto-ammonium chloride Formula: C12H21ClN4O3 MolecularWeight: 304.77314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN(C1=C[NH+]=O)CCCC(C)(C)[N+](=O)[O-].[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C12H20N4O3.ClH/c1-4-14-8-9-15(11(14)10-13-17)7-5-6-12(2,3)16(18)19;/h8-10H,4-7H2,1-3H3;1H/b11-10-;