4-(6-chloranylpyridazin-3-yl)-1,1-dimethyl-1,4-diazepan-1-ium iodide

Systemtic Name: 4-(6-chloranylpyridazin-3-yl)-1,1-dimethyl-1,4-diazepan-1-ium iodide Openeye Name: 4-(6-chloropyridazin-3-yl)-1,1-dimethyl-1,4-diazepan-1-ium iodide CAS Name: 4-(6-chloro-3-pyridazinyl)-1,1-dimethyl-1,4-diazepan-1-ium iodide IUPAC Name: 4-(6-chloropyridazin-3-yl)-1,1-dimethyl-1,4-diazepan-1-ium iodide Traditional Name: 4-(6-chloropyridazin-3-yl)-1,1-dimethyl-1,4-diazepan-1-ium iodide Formula: C11H18ClIN4 MolecularWeight: 368.64489

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCN(CC1)C2=NN=C(C=C2)Cl)C.[I-]

Isomeric SMILES

C[N+]1(CCCN(CC1)C2=NN=C(C=C2)Cl)C.[I-]

InChI

InChI=1S/C11H18ClN4.HI/c1-16(2)8-3-6-15(7-9-16)11-5-4-10(12)13-14-11;/h4-5H,3,6-9H2,1-2H3;1H/q+1;/p-1