[3-[(6-chloranylpyridazin-3-yl)methyl]-4-methoxy-phenyl]iodanium perchlorate

Systemtic Name: [3-[(6-chloranylpyridazin-3-yl)methyl]-4-methoxy-phenyl]iodanium perchlorate Openeye Name: [3-[(6-chloropyridazin-3-yl)methyl]-4-methoxy-phenyl]iodonium perchlorate CAS Name: [3-[(6-chloro-3-pyridazinyl)methyl]-4-methoxyphenyl]iodonium perchlorate IUPAC Name: [3-[(6-chloropyridazin-3-yl)methyl]-4-methoxyphenyl]iodanium perchlorate Traditional Name: [3-[(6-chloropyridazin-3-yl)methyl]-4-methoxy-phenyl]iodonium perchlorate Formula: C12H11Cl2IN2O5 MolecularWeight: 461.03661

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[IH+])CC2=NN=C(C=C2)Cl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=C(C=C(C=C1)[IH+])CC2=NN=C(C=C2)Cl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H11ClIN2O.ClHO4/c1-17-11-4-2-9(14)6-8(11)7-10-3-5-12(13)16-15-10;2-1(3,4)5/h2-6,14H,7H2,1H3;(H,2,3,4,5)/q+1;/p-1