9-(5-nitropyridin-2-yl)-3H-purine-2,6-dione

Systemtic Name: 9-(5-nitropyridin-2-yl)-3H-purine-2,6-dione Openeye Name: 9-(5-nitro-2-pyridyl)-3H-purine-2,6-dione CAS Name: 9-(5-nitro-2-pyridinyl)-3H-purine-2,6-dione IUPAC Name: 9-(5-nitropyridin-2-yl)-3H-purine-2,6-dione Traditional Name: 9-(5-nitro-2-pyridyl)xanthine Formula: C10H6N6O4 MolecularWeight: 274.19244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1[N+](=O)[O-])N2C=NC3=C2NC(=O)NC3=O

Isomeric SMILES

C1=CC(=NC=C1[N+](=O)[O-])N2C=NC3=C2NC(=O)NC3=O

InChI

InChI=1S/C10H6N6O4/c17-9-7-8(13-10(18)14-9)15(4-12-7)6-2-1-5(3-11-6)16(19)20/h1-4H,(H2,13,14,17,18)