[3-(2-chloranyl-4-methoxy-phenoxy)-2-oxidanyl-propyl]-[2-(6-diazanylpyridazin-3-yl)oxyethyl]-dimethyl-azanium

Systemtic Name: [3-(2-chloranyl-4-methoxy-phenoxy)-2-oxidanyl-propyl]-[2-(6-diazanylpyridazin-3-yl)oxyethyl]-dimethyl-azanium Openeye Name: [3-(2-chloro-4-methoxy-phenoxy)-2-hydroxy-propyl]-[2-(6-hydrazinopyridazin-3-yl)oxyethyl]-dimethyl-ammonium CAS Name: [3-(2-chloro-4-methoxyphenoxy)-2-hydroxypropyl]-[2-[(6-hydrazinyl-3-pyridazinyl)oxy]ethyl]-dimethylammonium IUPAC Name: [3-(2-chloro-4-methoxyphenoxy)-2-hydroxypropyl]-[2-(6-hydrazinylpyridazin-3-yl)oxyethyl]-dimethylazanium Traditional Name: [3-(2-chloro-4-methoxy-phenoxy)-2-hydroxy-propyl]-[2-(6-hydrazinopyridazin-3-yl)oxyethyl]-dimethyl-ammonium Formula: C18H27ClN5O4+ MolecularWeight: 412.89108

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCOC1=NN=C(C=C1)NN)CC(COC2=C(C=C(C=C2)OC)Cl)O

Isomeric SMILES

C[N+](C)(CCOC1=NN=C(C=C1)NN)CC(COC2=C(C=C(C=C2)OC)Cl)O

InChI

InChI=1S/C18H27ClN5O4/c1-24(2,8-9-27-18-7-6-17(21-20)22-23-18)11-13(25)12-28-16-5-4-14(26-3)10-15(16)19/h4-7,10,13,25H,8-9,11-12,20H2,1-3H3,(H,21,22)/q+1