Chem
J-GLOBAL ID：200907033705357884   Nikkaji number：J472.614F

6-Methyl-2-phenyl-4-[6-[(4-chlorophenyl)methoxy]-3-nitrophenyl]pyrimidine-5-carboxylic acid ethyl ester

6-メチル-2-フェニル-4-[6-[(4-クロロフェニル)メトキシ]-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： C27H22ClN2[N+]O4[O-]
Molecular formula furigana： C27-H22-CL-N3-O5
Molecular weight： 503.940
InChI： InChI=1S/C27H22ClN3O5/c1-3-35-27(32)24-17(2)29-26(19-7-5-4-6-8-19)30-25(24)22-15-21(31(33)34)13-14-23(22)36-16-18-9-11-20(28)12-10-18/h4-15H,3,16H2,1-2H3
InChI key： CBESPYXFEOBFJG-UHFFFAOYSA-N
SMILES： CCOC(=O)c1c(C)nc(nc1c1cc(ccc1OCc1ccc(Cl)cc1)[N+](=O)[O-])c1ccccc1
Systematic name  (3)：
  • 6-メチル-2-フェニル-4-[6-[(4-クロロフェニル)メトキシ]-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-{2-[(4-クロロフェニル)メトキシ]-5-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-{2-[(4-chlorophenyl)methoxy]-5-nitrophenyl}-6-methyl-2-phenylpyrimidine-5-carboxylate
Other name (1)：
  • 6-Methyl-2-phenyl-4-[6-[(4-chlorophenyl)methoxy]-3-nitrophenyl]pyrimidine-5-carboxylic acid ethyl ester
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