1-phenanthren-3-yl-2-pyridin-1-ium-1-yl-ethanone iodide

Systemtic Name: 1-phenanthren-3-yl-2-pyridin-1-ium-1-yl-ethanone iodide Openeye Name: 1-(3-phenanthryl)-2-pyridin-1-ium-1-yl-ethanone iodide CAS Name: 1-(3-phenanthrenyl)-2-(1-pyridin-1-iumyl)ethanone iodide IUPAC Name: 1-phenanthren-3-yl-2-pyridin-1-ium-1-ylethanone iodide Traditional Name: 1-(3-phenanthryl)-2-pyridin-1-ium-1-yl-ethanone iodide Formula: C21H16INO MolecularWeight: 425.26231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(=O)C2=CC3=C(C=CC4=CC=CC=C43)C=C2.[I-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC(=O)C2=CC3=C(C=CC4=CC=CC=C43)C=C2.[I-]

InChI

InChI=1S/C21H16NO.HI/c23-21(15-22-12-4-1-5-13-22)18-11-10-17-9-8-16-6-2-3-7-19(16)20(17)14-18;/h1-14H,15H2;1H/q+1;/p-1