6-[3,8-bis(azanyl)-6-phenyl-phenanthridin-5-ium-5-yl]hexyl-trimethyl-azanium diiodide

Systemtic Name: 6-[3,8-bis(azanyl)-6-phenyl-phenanthridin-5-ium-5-yl]hexyl-trimethyl-azanium diiodide Openeye Name: 6-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)hexyl-trimethyl-ammonium diiodide CAS Name: 6-(3,8-diamino-6-phenyl-5-phenanthridin-5-iumyl)hexyl-trimethylammonium diiodide IUPAC Name: 6-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)hexyl-trimethylazanium diiodide Traditional Name: 6-(3,8-diamino-6-phenyl-phenanthridin-5-ium-5-yl)hexyl-trimethyl-ammonium diiodide Formula: C28H36I2N4 MolecularWeight: 682.42118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N4.2HI/c1-32(2,3)18-10-5-4-9-17-31-27-20-23(30)14-16-25(27)24-15-13-22(29)19-26(24)28(31)21-11-7-6-8-12-21;;/h6-8,11-16,19-20,30H,4-5,9-10,17-18,29H2,1-3H3;2*1H/q+1;;/p-1