2-[3,8-bis(azanyl)-6-phenyl-phenanthridin-5-ium-5-yl]ethyl-diethyl-methyl-azanium diiodide

Systemtic Name: 2-[3,8-bis(azanyl)-6-phenyl-phenanthridin-5-ium-5-yl]ethyl-diethyl-methyl-azanium diiodide Openeye Name: 2-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)ethyl-diethyl-methyl-ammonium diiodide CAS Name: 2-(3,8-diamino-6-phenyl-5-phenanthridin-5-iumyl)ethyl-diethyl-methylammonium diiodide IUPAC Name: 2-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)ethyl-diethyl-methylazanium diiodide Traditional Name: 2-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)ethyl-diethyl-methyl-ammonium diiodide Formula: C26H32I2N4 MolecularWeight: 654.36802

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[I-].[I-]

Isomeric SMILES

CC[N+](C)(CC)CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[I-].[I-]

InChI

InChI=1S/C26H31N4.2HI/c1-4-30(3,5-2)16-15-29-25-18-21(28)12-14-23(25)22-13-11-20(27)17-24(22)26(29)19-9-7-6-8-10-19;;/h6-14,17-18,28H,4-5,15-16,27H2,1-3H3;2*1H/q+1;;/p-1