5-butyl-6-methyl-3-(3-methylbutyl)-5H-pyrimidin-1-ium-2,4-dione

Systemtic Name: 5-butyl-6-methyl-3-(3-methylbutyl)-5H-pyrimidin-1-ium-2,4-dione Openeye Name: 5-butyl-3-isopentyl-6-methyl-5H-pyrimidin-1-ium-2,4-dione CAS Name: 5-butyl-6-methyl-3-(3-methylbutyl)-5H-pyrimidin-1-ium-2,4-dione IUPAC Name: 5-butyl-6-methyl-3-(3-methylbutyl)-5H-pyrimidin-1-ium-2,4-dione Traditional Name: 5-butyl-3-isoamyl-6-methyl-5H-pyrimidin-1-ium-2,4-quinone Formula: C14H25N2O2+ MolecularWeight: 253.3605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=[NH+]C(=O)N(C1=O)CCC(C)C)C

Isomeric SMILES

CCCCC1C(=[NH+]C(=O)N(C1=O)CCC(C)C)C

InChI

InChI=1S/C14H24N2O2/c1-5-6-7-12-11(4)15-14(18)16(13(12)17)9-8-10(2)3/h10,12H,5-9H2,1-4H3/p+1