1-[3,4-bis(oxidanyl)phenyl]-2-pyridin-1-ium-1-yl-ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-pyridin-1-ium-1-yl-ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-yl-ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-(1-pyridin-1-iumyl)ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-ylethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-yl-ethanone Formula: C13H12NO3+ MolecularWeight: 230.23928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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