6-[(Z)-2-(1-methylpyridin-1-ium-3-yl)ethenyl]phenanthridine iodide

Systemtic Name: 6-[(Z)-2-(1-methylpyridin-1-ium-3-yl)ethenyl]phenanthridine iodide Openeye Name: 6-[(Z)-2-(1-methylpyridin-1-ium-3-yl)vinyl]phenanthridine iodide CAS Name: 6-[(Z)-2-(1-methyl-3-pyridin-1-iumyl)ethenyl]phenanthridine iodide IUPAC Name: 6-[(Z)-2-(1-methylpyridin-1-ium-3-yl)ethenyl]phenanthridine iodide Traditional Name: 6-[(Z)-2-(1-methylpyridin-1-ium-3-yl)vinyl]phenanthridine iodide Formula: C21H17IN2 MolecularWeight: 424.27755

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C=CC2=NC3=CC=CC=C3C4=CC=CC=C42.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)/C=C\C2=NC3=CC=CC=C3C4=CC=CC=C42.[I-]

InChI

InChI=1S/C21H17N2.HI/c1-23-14-6-7-16(15-23)12-13-21-19-9-3-2-8-17(19)18-10-4-5-11-20(18)22-21;/h2-15H,1H3;1H/q+1;/p-1/b13-12-;