(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-[3-[(4-methylphenyl)sulfonylamino]propylimino]-oxidanidyl-azanium

Systemtic Name: (2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-[3-[(4-methylphenyl)sulfonylamino]propylimino]-oxidanidyl-azanium Openeye Name: (2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-oxido-[3-(p-tolylsulfonylamino)propylimino]ammonium CAS Name: (2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-[3-[(4-methylphenyl)sulfonylamino]propylimino]-oxidoammonium IUPAC Name: (2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-[3-[(4-methylphenyl)sulfonylamino]propylimino]-oxidoazanium Traditional Name: (2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-oxido-[3-(tosylamino)propylimino]ammonium Formula: C16H24N4O7S MolecularWeight: 416.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCN=[N+](C2(COC(OC2)(C)C)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCN=[N+](C2(COC(OC2)(C)C)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H24N4O7S/c1-13-5-7-14(8-6-13)28(24,25)18-10-4-9-17-19(21)16(20(22)23)11-26-15(2,3)27-12-16/h5-8,18H,4,9-12H2,1-3H3