6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-3,8-diamine chloride

Systemtic Name: 6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-3,8-diamine chloride Openeye Name: 6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-3,8-diamine chloride CAS Name: 6-(4-aminophenyl)-5-propylphenanthridin-5-ium-3,8-diamine chloride IUPAC Name: 6-(4-aminophenyl)-5-propylphenanthridin-5-ium-3,8-diamine chloride Traditional Name: [3-amino-6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-8-yl]amine chloride Formula: C22H23ClN4 MolecularWeight: 378.89782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4.ClH/c1-2-11-26-21-13-17(25)8-10-19(21)18-9-7-16(24)12-20(18)22(26)14-3-5-15(23)6-4-14;/h3-10,12-13H,2,11,24H2,1H3,(H3,23,25);1H