2,4-bis(azanyl)-6-(4-nitrophenyl)-8H-pteridin-7-one

Systemtic Name: 2,4-bis(azanyl)-6-(4-nitrophenyl)-8H-pteridin-7-one Openeye Name: 2,4-diamino-6-(4-nitrophenyl)-8H-pteridin-7-one CAS Name: 2,4-diamino-6-(4-nitrophenyl)-8H-pteridin-7-one IUPAC Name: 2,4-diamino-6-(4-nitrophenyl)-8H-pteridin-7-one Traditional Name: 2,4-diamino-6-(4-nitrophenyl)-8H-pteridin-7-one Formula: C12H9N7O3 MolecularWeight: 299.24496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(NC2=O)N=C(N=C3N)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(NC2=O)N=C(N=C3N)N)[N+](=O)[O-]

InChI

InChI=1S/C12H9N7O3/c13-9-8-10(18-12(14)16-9)17-11(20)7(15-8)5-1-3-6(4-2-5)19(21)22/h1-4H,(H5,13,14,16,17,18,20)