ethyl N-[6-[(Z)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]phenanthridin-8-yl]carbamate iodide

Systemtic Name: ethyl N-[6-[(Z)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]phenanthridin-8-yl]carbamate iodide Openeye Name: ethyl N-[6-[(Z)-2-(1-methylpyridin-1-ium-4-yl)vinyl]phenanthridin-8-yl]carbamate iodide CAS Name: N-[6-[(Z)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]-8-phenanthridinyl]carbamic acid ethyl ester iodide IUPAC Name: ethyl N-[6-[(Z)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]phenanthridin-8-yl]carbamate iodide Traditional Name: N-[6-[(Z)-2-(1-methylpyridin-1-ium-4-yl)vinyl]phenanthridin-8-yl]carbamic acid ethyl ester iodide Formula: C24H22IN3O2 MolecularWeight: 511.35485

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3N=C2C=CC4=CC=[N+](C=C4)C.[I-]

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3N=C2/C=C\C4=CC=[N+](C=C4)C.[I-]

InChI

InChI=1S/C24H21N3O2.HI/c1-3-29-24(28)25-18-9-10-19-20-6-4-5-7-22(20)26-23(21(19)16-18)11-8-17-12-14-27(2)15-13-17;/h4-16H,3H2,1-2H3;1H