1-butyl-3-methyl-5-nitro-pyrimidine-2,4-dione

Systemtic Name: 1-butyl-3-methyl-5-nitro-pyrimidine-2,4-dione Openeye Name: 1-butyl-3-methyl-5-nitro-pyrimidine-2,4-dione CAS Name: 1-butyl-3-methyl-5-nitropyrimidine-2,4-dione IUPAC Name: 1-butyl-3-methyl-5-nitropyrimidine-2,4-dione Traditional Name: 1-butyl-3-methyl-5-nitro-pyrimidine-2,4-quinone Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)N(C1=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C=C(C(=O)N(C1=O)C)[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O4/c1-3-4-5-11-6-7(12(15)16)8(13)10(2)9(11)14/h6H,3-5H2,1-2H3