dimethyl-bis[3-(2-nitroimidazol-1-yl)propyl]azanium iodide

Systemtic Name: dimethyl-bis[3-(2-nitroimidazol-1-yl)propyl]azanium iodide Openeye Name: dimethyl-bis[3-(2-nitroimidazol-1-yl)propyl]ammonium iodide CAS Name: dimethyl-bis[3-(2-nitro-1-imidazolyl)propyl]ammonium iodide IUPAC Name: dimethyl-bis[3-(2-nitroimidazol-1-yl)propyl]azanium iodide Traditional Name: dimethyl-bis[3-(2-nitroimidazol-1-yl)propyl]ammonium iodide Formula: C14H22IN7O4 MolecularWeight: 479.27345

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCN1C=CN=C1[N+](=O)[O-])CCCN2C=CN=C2[N+](=O)[O-].[I-]

Isomeric SMILES

C[N+](C)(CCCN1C=CN=C1[N+](=O)[O-])CCCN2C=CN=C2[N+](=O)[O-].[I-]

InChI

InChI=1S/C14H22N7O4.HI/c1-21(2,11-3-7-17-9-5-15-13(17)19(22)23)12-4-8-18-10-6-16-14(18)20(24)25;/h5-6,9-10H,3-4,7-8,11-12H2,1-2H3;1H/q+1;/p-1