N-(2-hydroxyethyl)-2-[8-nitro-2,6-bis(oxidanylidene)-3H-purin-7-yl]ethanamide

Systemtic Name: N-(2-hydroxyethyl)-2-[8-nitro-2,6-bis(oxidanylidene)-3H-purin-7-yl]ethanamide Openeye Name: N-(2-hydroxyethyl)-2-(8-nitro-2,6-dioxo-3H-purin-7-yl)acetamide CAS Name: N-(2-hydroxyethyl)-2-(8-nitro-2,6-dioxo-3H-purin-7-yl)acetamide IUPAC Name: N-(2-hydroxyethyl)-2-(8-nitro-2,6-dioxo-3H-purin-7-yl)acetamide Traditional Name: 2-(2,6-diketo-8-nitro-3H-purin-7-yl)-N-(2-hydroxyethyl)acetamide Formula: C9H10N6O6 MolecularWeight: 298.2123

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)NC(=O)CN1C2=C(NC(=O)NC2=O)N=C1[N+](=O)[O-]

Isomeric SMILES

C(CO)NC(=O)CN1C2=C(NC(=O)NC2=O)N=C1[N+](=O)[O-]

InChI

InChI=1S/C9H10N6O6/c16-2-1-10-4(17)3-14-5-6(12-9(14)15(20)21)11-8(19)13-7(5)18/h16H,1-3H2,(H,10,17)(H2,11,13,18,19)