5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-7-amine chloride

Systemtic Name: 5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-7-amine chloride Openeye Name: 5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-7-amine chloride CAS Name: 5-methyl-6-(4-nitrophenyl)-7-phenanthridin-5-iumamine chloride IUPAC Name: 5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-7-amine chloride Traditional Name: [5-methyl-6-(4-nitrophenyl)phenanthridin-5-ium-7-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=CC=C2N)C3=CC=CC=C31)C4=CC=C(C=C4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

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

InChI

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