1-oxidanidyl-2-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-1-ium-5,7-dione

Systemtic Name: 1-oxidanidyl-2-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-1-ium-5,7-dione Openeye Name: 1-oxido-2-phenyl-3H-triazolo[4,5-d]pyrimidin-1-ium-5,7-dione CAS Name: 1-oxido-2-phenyl-3H-triazolo[4,5-d]pyrimidin-1-ium-5,7-dione IUPAC Name: 1-oxido-2-phenyl-3H-triazolo[4,5-d]pyrimidin-1-ium-5,7-dione Traditional Name: 1-oxido-2-phenyl-3H-triazolo[4,5-d]pyrimidin-1-ium-5,7-quinone Formula: C10H7N5O3 MolecularWeight: 245.19428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2NC3=NC(=O)NC(=O)C3=[N+]2[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2NC3=NC(=O)NC(=O)C3=[N+]2[O-]

InChI

InChI=1S/C10H7N5O3/c16-9-7-8(11-10(17)12-9)13-14(15(7)18)6-4-2-1-3-5-6/h1-5H,(H2,11,12,13,16,17)