trimethyl-[2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethyl]azanium iodide

Systemtic Name: trimethyl-[2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethyl]azanium iodide Openeye Name: trimethyl-[2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethyl]ammonium iodide CAS Name: trimethyl-[2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethyl]ammonium iodide IUPAC Name: trimethyl-[2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]ethyl]azanium iodide Traditional Name: trimethyl-[2-[methyl-(7-nitrobenzofurazan-4-yl)amino]ethyl]ammonium iodide Formula: C12H18IN5O3 MolecularWeight: 407.20749

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[N+](C)(C)C)C1=CC=C(C2=NON=C12)[N+](=O)[O-].[I-]

Isomeric SMILES

CN(CC[N+](C)(C)C)C1=CC=C(C2=NON=C12)[N+](=O)[O-].[I-]

InChI

InChI=1S/C12H18N5O3.HI/c1-15(7-8-17(2,3)4)9-5-6-10(16(18)19)12-11(9)13-20-14-12;/h5-6H,7-8H2,1-4H3;1H/q+1;/p-1