2-(2,2-dimethylpropyl)-5-nitro-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-(2,2-dimethylpropyl)-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-(2,2-dimethylpropyl)-4-hydroxy-5-nitro-1H-pyrimidin-6-one CAS Name: 2-(2,2-dimethylpropyl)-4-hydroxy-5-nitro-1H-pyrimidin-6-one IUPAC Name: 2-(2,2-dimethylpropyl)-4-hydroxy-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-neopentyl-5-nitro-1H-pyrimidin-6-one Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NC(=C(C(=O)N1)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)CC1=NC(=C(C(=O)N1)[N+](=O)[O-])O

InChI

InChI=1S/C9H13N3O4/c1-9(2,3)4-5-10-7(13)6(12(15)16)8(14)11-5/h4H2,1-3H3,(H2,10,11,13,14)