pentan-3-yl-[2-[6-[2-(pentan-3-ylazaniumyl)ethoxy]pyridazin-3-yl]oxyethyl]azanium diiodide

Systemtic Name: pentan-3-yl-[2-[6-[2-(pentan-3-ylazaniumyl)ethoxy]pyridazin-3-yl]oxyethyl]azanium diiodide Openeye Name: 1-ethylpropyl-[2-[6-[2-(1-ethylpropylammonio)ethoxy]pyridazin-3-yl]oxyethyl]ammonium diiodide CAS Name: pentan-3-yl-[2-[[6-[2-(pentan-3-ylammonio)ethoxy]-3-pyridazinyl]oxy]ethyl]ammonium diiodide IUPAC Name: pentan-3-yl-[2-[6-[2-(pentan-3-ylazaniumyl)ethoxy]pyridazin-3-yl]oxyethyl]azanium diiodide Traditional Name: 1-ethylpropyl-[2-[6-[2-(1-ethylpropylammonio)ethoxy]pyridazin-3-yl]oxyethyl]ammonium diiodide Formula: C18H36I2N4O2 MolecularWeight: 594.31298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CCOC1=NN=C(C=C1)OCC[NH2+]C(CC)CC.[I-].[I-]

Isomeric SMILES

CCC(CC)[NH2+]CCOC1=NN=C(C=C1)OCC[NH2+]C(CC)CC.[I-].[I-]

InChI

InChI=1S/C18H34N4O2.2HI/c1-5-15(6-2)19-11-13-23-17-9-10-18(22-21-17)24-14-12-20-16(7-3)8-4;;/h9-10,15-16,19-20H,5-8,11-14H2,1-4H3;2*1H