6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-8-amine chloride

Systemtic Name: 6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-8-amine chloride Openeye Name: 6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-8-amine chloride CAS Name: 6-(4-aminophenyl)-5-propyl-8-phenanthridin-5-iumamine chloride IUPAC Name: 6-(4-aminophenyl)-5-propylphenanthridin-5-ium-8-amine chloride Traditional Name: [6-(4-aminophenyl)-5-propyl-phenanthridin-5-ium-8-yl]amine chloride Formula: C22H22ClN3 MolecularWeight: 363.88318

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C2=C(C=CC(=C2)N)C3=CC=CC=C31)C4=CC=C(C=C4)N.[Cl-]

Isomeric SMILES

CCC[N+]1=C(C2=C(C=CC(=C2)N)C3=CC=CC=C31)C4=CC=C(C=C4)N.[Cl-]

InChI

InChI=1S/C22H21N3.ClH/c1-2-13-25-21-6-4-3-5-19(21)18-12-11-17(24)14-20(18)22(25)15-7-9-16(23)10-8-15;/h3-12,14,23H,2,13,24H2,1H3;1H