7-nitro-5-oxidanidyl-2-phenyl-1H-benzo[g]pteridin-5-ium-4-one

Systemtic Name: 7-nitro-5-oxidanidyl-2-phenyl-1H-benzo[g]pteridin-5-ium-4-one Openeye Name: 7-nitro-5-oxido-2-phenyl-1H-benzo[g]pteridin-5-ium-4-one CAS Name: 7-nitro-5-oxido-2-phenyl-1H-benzo[g]pteridin-5-ium-4-one IUPAC Name: 7-nitro-5-oxido-2-phenyl-1H-benzo[g]pteridin-5-ium-4-one Traditional Name: 7-nitro-5-oxido-2-phenyl-1H-benzo[g]pteridin-5-ium-4-one Formula: C16H9N5O4 MolecularWeight: 335.27376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)C3=[N+](C4=C(C=CC(=C4)[N+](=O)[O-])N=C3N2)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)C3=[N+](C4=C(C=CC(=C4)[N+](=O)[O-])N=C3N2)[O-]

InChI

InChI=1S/C16H9N5O4/c22-16-13-15(18-14(19-16)9-4-2-1-3-5-9)17-11-7-6-10(21(24)25)8-12(11)20(13)23/h1-8H,(H,17,18,19,22)