1,3,7-trimethyl-5-oxidanidyl-benzo[g]pteridin-5-ium-2,4-dione

Systemtic Name: 1,3,7-trimethyl-5-oxidanidyl-benzo[g]pteridin-5-ium-2,4-dione Openeye Name: 1,3,7-trimethyl-5-oxido-benzo[g]pteridin-5-ium-2,4-dione CAS Name: 1,3,7-trimethyl-5-oxidobenzo[g]pteridin-5-ium-2,4-dione IUPAC Name: 1,3,7-trimethyl-5-oxidobenzo[g]pteridin-5-ium-2,4-dione Traditional Name: 1,3,7-trimethyl-5-oxido-benzo[g]pteridin-5-ium-2,4-quinone Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C3C(=[N+]2[O-])C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C3C(=[N+]2[O-])C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C13H12N4O3/c1-7-4-5-8-9(6-7)17(20)10-11(14-8)15(2)13(19)16(3)12(10)18/h4-6H,1-3H3