2-(6-diazanylpyridazin-3-yl)oxyethyl-dimethyl-[2-oxidanyl-3-(2-prop-2-enoxyphenoxy)propyl]azanium hydrochloride

Systemtic Name: 2-(6-diazanylpyridazin-3-yl)oxyethyl-dimethyl-[2-oxidanyl-3-(2-prop-2-enoxyphenoxy)propyl]azanium hydrochloride Openeye Name: [3-(2-allyloxyphenoxy)-2-hydroxy-propyl]-[2-(6-hydrazinopyridazin-3-yl)oxyethyl]-dimethyl-ammonium hydrochloride CAS Name: 2-[(6-hydrazinyl-3-pyridazinyl)oxy]ethyl-[2-hydroxy-3-(2-prop-2-enoxyphenoxy)propyl]-dimethylammonium hydrochloride IUPAC Name: 2-(6-hydrazinylpyridazin-3-yl)oxyethyl-[2-hydroxy-3-(2-prop-2-enoxyphenoxy)propyl]-dimethylazanium hydrochloride Traditional Name: [3-(2-allyloxyphenoxy)-2-hydroxy-propyl]-[2-(6-hydrazinopyridazin-3-yl)oxyethyl]-dimethyl-ammonium hydrochloride Formula: C20H31ClN5O4+ MolecularWeight: 440.94424

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCOC1=NN=C(C=C1)NN)CC(COC2=CC=CC=C2OCC=C)O.Cl

Isomeric SMILES

C[N+](C)(CCOC1=NN=C(C=C1)NN)CC(COC2=CC=CC=C2OCC=C)O.Cl

InChI

InChI=1S/C20H30N5O4.ClH/c1-4-12-27-17-7-5-6-8-18(17)29-15-16(26)14-25(2,3)11-13-28-20-10-9-19(22-21)23-24-20;/h4-10,16,26H,1,11-15,21H2,2-3H3,(H,22,23);1H/q+1;