Chem
J-GLOBAL ID:200907051058407961   Nikkaji number:J1.877.538G

5,5′-(1,3-Phenylenebismethylene)bisbarbituric acid

5,5′-(1,3-フェニレンビスメチレン)ビスバルビツル酸
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C16H14N4O6
Molecular formula furigana: C16-H14-N4-O6
Molecular weight: 358.310
InChI: InChI=1S/C16H14N4O6/c21-11-9(12(22)18-15(25)17-11)5-7-2-1-3-8(4-7)6-10-13(23)19-16(26)20-14(10)24/h1-4,9-10H,5-6H2,(H2,17,18,21,22,25)(H2,19,20,23,24,26)
InChI key: NDLHGJMBCMMGLT-UHFFFAOYSA-N
SMILES: O=C1NC(=O)C(Cc2cccc(CC3C(=O)NC(=O)NC3=O)c2)C(=O)N1
Systematic name  (3):
  • 5,5′-(1,3-フェニレンビスメチレン)ビスバルビツル酸
  • 5-({3-[(2,4,6-トリオキソ-1,3-ジアジナン-5-イル)メチル]フェニル}メチル)-1,3-ジアジナン-2,4,6-トリオン
  • 5-({3-[(2,4,6-trioxo-1,3-diazinan-5-yl)methyl]phenyl}methyl)-1,3-diazinane-2,4,6-trione
Other name (1):
  • 5,5′-(1,3-Phenylenebismethylene)bisbarbituric acid
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