1-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-ethanone perchlorate

Systemtic Name: 1-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-ethanone perchlorate Openeye Name: 1-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-ethanone perchlorate CAS Name: 1-(3-nitrophenyl)-2-(1-pyridin-1-iumyl)ethanone perchlorate IUPAC Name: 1-(3-nitrophenyl)-2-pyridin-1-ium-1-ylethanone perchlorate Traditional Name: 1-(3-nitrophenyl)-2-pyridin-1-ium-1-yl-ethanone perchlorate Formula: C13H11ClN2O7 MolecularWeight: 342.68864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N2O3.ClHO4/c16-13(10-14-7-2-1-3-8-14)11-5-4-6-12(9-11)15(17)18;2-1(3,4)5/h1-9H,10H2;(H,2,3,4,5)/q+1;/p-1