7,8,10-trimethyl-9-nitro-5-oxidanidyl-benzo[g]pteridin-5-ium-2,4-dione

Systemtic Name: 7,8,10-trimethyl-9-nitro-5-oxidanidyl-benzo[g]pteridin-5-ium-2,4-dione Openeye Name: 7,8,10-trimethyl-9-nitro-5-oxido-benzo[g]pteridin-5-ium-2,4-dione CAS Name: 7,8,10-trimethyl-9-nitro-5-oxidobenzo[g]pteridin-5-ium-2,4-dione IUPAC Name: 7,8,10-trimethyl-9-nitro-5-oxidobenzo[g]pteridin-5-ium-2,4-dione Traditional Name: 7,8,10-trimethyl-9-nitro-5-oxido-benzo[g]pteridin-5-ium-2,4-quinone Formula: C13H11N5O5 MolecularWeight: 317.25694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C)[N+](=O)[O-])N(C3=NC(=O)NC(=O)C3=[N+]2[O-])C

Isomeric SMILES

CC1=CC2=C(C(=C1C)[N+](=O)[O-])N(C3=NC(=O)NC(=O)C3=[N+]2[O-])C

InChI

InChI=1S/C13H11N5O5/c1-5-4-7-9(8(6(5)2)18(22)23)16(3)11-10(17(7)21)12(19)15-13(20)14-11/h4H,1-3H3,(H,15,19,20)