6-(3-methoxyphenyl)-5-methyl-phenanthridin-5-ium-3,8-diamine bromide

Systemtic Name: 6-(3-methoxyphenyl)-5-methyl-phenanthridin-5-ium-3,8-diamine bromide Openeye Name: 6-(3-methoxyphenyl)-5-methyl-phenanthridin-5-ium-3,8-diamine bromide CAS Name: 6-(3-methoxyphenyl)-5-methylphenanthridin-5-ium-3,8-diamine bromide IUPAC Name: 6-(3-methoxyphenyl)-5-methylphenanthridin-5-ium-3,8-diamine bromide Traditional Name: [3-amino-6-(3-methoxyphenyl)-5-methyl-phenanthridin-5-ium-8-yl]amine bromide Formula: C21H20BrN3O MolecularWeight: 410.307

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O.BrH/c1-24-20-12-15(23)7-9-18(20)17-8-6-14(22)11-19(17)21(24)13-4-3-5-16(10-13)25-2;/h3-12,23H,22H2,1-2H3;1H