3-butyl-6-methyl-1-(3-methylbutyl)-5-nitro-pyrimidine-2,4-dione

Systemtic Name: 3-butyl-6-methyl-1-(3-methylbutyl)-5-nitro-pyrimidine-2,4-dione Openeye Name: 3-butyl-1-isopentyl-6-methyl-5-nitro-pyrimidine-2,4-dione CAS Name: 3-butyl-6-methyl-1-(3-methylbutyl)-5-nitropyrimidine-2,4-dione IUPAC Name: 3-butyl-6-methyl-1-(3-methylbutyl)-5-nitropyrimidine-2,4-dione Traditional Name: 3-butyl-1-isoamyl-6-methyl-5-nitro-pyrimidine-2,4-quinone Formula: C14H23N3O4 MolecularWeight: 297.35012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O4/c1-5-6-8-16-13(18)12(17(20)21)11(4)15(14(16)19)9-7-10(2)3/h10H,5-9H2,1-4H3