Chem
J-GLOBAL ID:201707007916773711   Nikkaji number:J3.568.580D

3-Methyl-6-tert-butylisoquinoline-4-carboxylic acid ethyl ester

3-メチル-6-tert-ブチルイソキノリン-4-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: C17H21NO2
Molecular formula furigana: C17-H21-N-O2
Molecular weight: 271.360
InChI: InChI=1S/C17H21NO2/c1-6-20-16(19)15-11(2)18-10-12-7-8-13(9-14(12)15)17(3,4)5/h7-10H,6H2,1-5H3
InChI key: DAPDQOZLSMJXSF-UHFFFAOYSA-N
SMILES: CCOC(=O)c1c(C)ncc2ccc(cc12)C(C)(C)C
Systematic name  (3):
  • 3-メチル-6-tert-ブチルイソキノリン-4-カルボン酸エチル
  • エチル 6-tert-ブチル-3-メチルイソキノリン-4-カルボキシラート
  • ethyl 6-tert-butyl-3-methylisoquinoline-4-carboxylate
Other name (1):
  • 3-Methyl-6-tert-butylisoquinoline-4-carboxylic acid ethyl ester
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