5-(8-methoxy-5-methyl-phenanthridin-5-ium-6-yl)benzene-1,3-diamine chloride

Systemtic Name: 5-(8-methoxy-5-methyl-phenanthridin-5-ium-6-yl)benzene-1,3-diamine chloride Openeye Name: 5-(8-methoxy-5-methyl-phenanthridin-5-ium-6-yl)benzene-1,3-diamine chloride CAS Name: 5-(8-methoxy-5-methyl-6-phenanthridin-5-iumyl)benzene-1,3-diamine chloride IUPAC Name: 5-(8-methoxy-5-methylphenanthridin-5-ium-6-yl)benzene-1,3-diamine chloride Traditional Name: [3-amino-5-(8-methoxy-5-methyl-phenanthridin-5-ium-6-yl)phenyl]amine chloride Formula: C21H20ClN3O MolecularWeight: 365.856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N3O.ClH/c1-24-20-6-4-3-5-18(20)17-8-7-16(25-2)12-19(17)21(24)13-9-14(22)11-15(23)10-13;/h3-12H,22-23H2,1-2H3;1H/q+1;/p-1