6-(4-aminophenyl)-5-methyl-phenanthridin-5-ium-7-amine bromide

Systemtic Name: 6-(4-aminophenyl)-5-methyl-phenanthridin-5-ium-7-amine bromide Openeye Name: 6-(4-aminophenyl)-5-methyl-phenanthridin-5-ium-7-amine bromide CAS Name: 6-(4-aminophenyl)-5-methyl-7-phenanthridin-5-iumamine bromide IUPAC Name: 6-(4-aminophenyl)-5-methylphenanthridin-5-ium-7-amine bromide Traditional Name: [4-(7-amino-5-methyl-phenanthridin-5-ium-6-yl)phenyl]amine bromide Formula: C20H18BrN3 MolecularWeight: 380.28102

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=C(C=CC=C2N)C3=CC=CC=C31)C4=CC=C(C=C4)N.[Br-]

Isomeric SMILES

C[N+]1=C(C2=C(C=CC=C2N)C3=CC=CC=C31)C4=CC=C(C=C4)N.[Br-]

InChI

InChI=1S/C20H17N3.BrH/c1-23-18-8-3-2-5-15(18)16-6-4-7-17(22)19(16)20(23)13-9-11-14(21)12-10-13;/h2-12H,1H3,(H3,21,22);1H