trimethyl-[3-[3-oxidanylidenebutanoyl-[3-(trimethylazaniumyl)propyl]amino]propyl]azanium diiodide

Systemtic Name: trimethyl-[3-[3-oxidanylidenebutanoyl-[3-(trimethylazaniumyl)propyl]amino]propyl]azanium diiodide Openeye Name: trimethyl-[3-[3-oxobutanoyl-[3-(trimethylammonio)propyl]amino]propyl]ammonium diiodide CAS Name: 3-[1,3-dioxobutyl-[3-(trimethylammonio)propyl]amino]propyl-trimethylammonium diiodide IUPAC Name: trimethyl-[3-[3-oxobutanoyl-[3-(trimethylazaniumyl)propyl]amino]propyl]azanium diiodide Traditional Name: 3-[acetoacetyl-[3-(trimethylammonio)propyl]amino]propyl-trimethyl-ammonium diiodide Formula: C16H35I2N3O2 MolecularWeight: 555.27694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)N(CCC[N+](C)(C)C)CCC[N+](C)(C)C.[I-].[I-]

Isomeric SMILES

CC(=O)CC(=O)N(CCC[N+](C)(C)C)CCC[N+](C)(C)C.[I-].[I-]

InChI

InChI=1S/C16H35N3O2.2HI/c1-15(20)14-16(21)17(10-8-12-18(2,3)4)11-9-13-19(5,6)7;;/h8-14H2,1-7H3;2*1H/q+2;;/p-2