10-(3-nitrophenyl)-3,10-dihydro-2H-imidazo[2,1-b]pteridin-5-ium 5-oxide

Systemtic Name: 10-(3-nitrophenyl)-3,10-dihydro-2H-imidazo[2,1-b]pteridin-5-ium 5-oxide Openeye Name: 10-(3-nitrophenyl)-3,10-dihydro-2H-imidazo[2,1-b]pteridin-5-ium 5-oxide CAS Name: 10-(3-nitrophenyl)-3,10-dihydro-2H-imidazo[2,1-b]pteridin-5-ium 5-oxide IUPAC Name: 10-(3-nitrophenyl)-3,10-dihydro-2H-imidazo[2,1-b]pteridin-5-ium 5-oxide Traditional Name: 10-(3-nitrophenyl)-3,10-dihydro-2H-imidazo[2,1-b]pteridin-5-ium 5-oxide Formula: C14H11N6O3+ MolecularWeight: 311.27554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C(=N1)C(N3C=CN=C3[N+]2=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN=C2C(=N1)C(N3C=CN=C3[N+]2=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C14H11N6O3/c21-19-13-11(15-4-5-16-13)12(18-7-6-17-14(18)19)9-2-1-3-10(8-9)20(22)23/h1-3,6-8,12H,4-5H2/q+1