Chem
J-GLOBAL ID:200907015552632602
Nikkaji number:J622.531D
8-[(E)-3-Chlorostyryl]-1,3,7-trimethylxanthine
8-[(E)-3-クロロスチリル]-1,3,7-トリメチルキサンチン
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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:
C16 H15 ClN4 O2
Molecular formula furigana:
C16-H15-CL-N4-O2
Molecular weight:
330.770
InChI:
InChI=1S/C16H15ClN4O2/c1-19-12(8-7-10-5-4-6-11(17)9-10)18-14-13(19)15(22)21(3)16(23)20(14)2/h4-9H,1-3H3/b8-7+
InChI key:
WBWFIUAVMCNYPG-BQYQJAHWSA-N
SMILES:
Cn1c(/C=C/c2cccc(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12
Systematic name (4):
1,3,7-トリメチル-8-[(E)-2-(3-クロロフェニル)エテニル]-1H-プリン-2,6(3H,7H)-ジオン
8-[(E)-3-クロロスチリル]-1,3,7-トリメチルキサンチン
8-[(1E)-2-(3-クロロフェニル)エテニル]-1,3,7-トリメチル-2,3,6,7-テトラヒドロ-1H-プリン-2,6-ジオン
8-[(1E)-2-(3-chlorophenyl)ethenyl]-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Other name (2):
1,3,7-Trimethyl-8-[(E)-2-(3-chlorophenyl)ethenyl]-1H-purine-2,6(3H,7H)-dione
8-[(E)-3-Chlorostyryl]-1,3,7-trimethylxanthine
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