5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-9-amine chloride

Systemtic Name: 5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-9-amine chloride Openeye Name: 5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-9-amine chloride CAS Name: 5-methyl-6-(4-nitrophenyl)-9-phenanthridin-5-iumamine chloride IUPAC Name: 5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-9-amine chloride Traditional Name: [5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-9-yl]amine chloride Formula: C20H16ClN3O2 MolecularWeight: 365.81294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O2.ClH/c1-22-19-5-3-2-4-16(19)18-12-14(21)8-11-17(18)20(22)13-6-9-15(10-7-13)23(24)25;/h2-12,21H,1H3;1H