Chem
J-GLOBAL ID：200907042431198660   Nikkaji number：J2.413.989A

2-Benzyl-1H-pyrrole-3,4-dicarboxylic acid 3-methyl 4-ethyl ester

2-ベンジル-1H-ピロール-3,4-ジカルボン酸3-メチル4-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： C16H17NO4
Molecular formula furigana： C16-H17-N-O4
Molecular weight： 287.315
InChI： InChI=1S/C16H17NO4/c1-3-21-15(18)12-10-17-13(14(12)16(19)20-2)9-11-7-5-4-6-8-11/h4-8,10,17H,3,9H2,1-2H3
InChI key： DTOCSYXIXLHMND-UHFFFAOYSA-N
SMILES： CCOC(=O)c1c[nH]c(Cc2ccccc2)c1C(=O)OC
Systematic name  (3)：
  • 2-ベンジル-1H-ピロール-3,4-ジカルボン酸3-メチル4-エチル
  • 4-エチル 3-メチル 2-ベンジル-1H-ピロール-3,4-ジカルボキシラート
  • 4-ethyl 3-methyl 2-benzyl-1H-pyrrole-3,4-dicarboxylate
Other name (1)：
  • 2-Benzyl-1H-pyrrole-3,4-dicarboxylic acid 3-methyl 4-ethyl ester
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