1-[2,4-bis(oxidanyl)phenyl]-2-pyridin-1-ium-1-yl-ethanone perchlorate

Systemtic Name: 1-[2,4-bis(oxidanyl)phenyl]-2-pyridin-1-ium-1-yl-ethanone perchlorate Openeye Name: 1-(2,4-dihydroxyphenyl)-2-pyridin-1-ium-1-yl-ethanone perchlorate CAS Name: 1-(2,4-dihydroxyphenyl)-2-(1-pyridin-1-iumyl)ethanone perchlorate IUPAC Name: 1-(2,4-dihydroxyphenyl)-2-pyridin-1-ium-1-ylethanone perchlorate Traditional Name: 1-(2,4-dihydroxyphenyl)-2-pyridin-1-ium-1-yl-ethanone perchlorate Formula: C13H12ClNO7 MolecularWeight: 329.68988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(=O)C2=C(C=C(C=C2)O)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=[N+](C=C1)CC(=O)C2=C(C=C(C=C2)O)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H11NO3.ClHO4/c15-10-4-5-11(12(16)8-10)13(17)9-14-6-2-1-3-7-14;2-1(3,4)5/h1-8H,9H2,(H-,15,16,17);(H,2,3,4,5)