Chem
J-GLOBAL ID：200907044080115900   Nikkaji number：J472.609J

6-Methyl-2-phenyl-4-[4-chloro-3-nitrophenyl]pyrimidine-5-carboxylic acid ethyl ester

6-メチル-2-フェニル-4-[4-クロロ-3-ニトロフェニル]ピリミジン-5-カルボン酸エチル
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： C20H16ClN2[N+]O3[O-]
Molecular formula furigana： C20-H16-CL-N3-O4
Molecular weight： 397.820
InChI： InChI=1S/C20H16ClN3O4/c1-3-28-20(25)17-12(2)22-19(13-7-5-4-6-8-13)23-18(17)14-9-10-15(21)16(11-14)24(26)27/h4-11H,3H2,1-2H3
InChI key： QGCFGSBCBUOHQP-UHFFFAOYSA-N
SMILES： CCOC(=O)c1c(C)nc(nc1c1ccc(Cl)c(c1)[N+](=O)[O-])c1ccccc1
Systematic name  (3)：
  • 6-メチル-2-フェニル-4-[4-クロロ-3-ニトロフェニル]ピリミジン-5-カルボン酸エチル
  • エチル 4-(4-クロロ-3-ニトロフェニル)-6-メチル-2-フェニルピリミジン-5-カルボキシラート
  • ethyl 4-(4-chloro-3-nitrophenyl)-6-methyl-2-phenylpyrimidine-5-carboxylate
Other name (1)：
  • 6-Methyl-2-phenyl-4-[4-chloro-3-nitrophenyl]pyrimidine-5-carboxylic acid ethyl ester
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