Chem
J-GLOBAL ID:201707000162530162
Nikkaji number:J3.644.911J
1-Phenacylisoquinoline-2(1H)-carboxylic acid 2,2,2-trichloroethyl ester
1-フェナシルイソキノリン-2(1H)-カルボン酸2,2,2-トリクロロエチル
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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:
C20 H16 Cl3 NO3
Molecular formula furigana:
C20-H16-CL3-N-O3
Molecular weight:
424.700
InChI:
InChI=1S/C20H16Cl3NO3/c21-20(22,23)13-27-19(26)24-11-10-14-6-4-5-9-16(14)17(24)12-18(25)15-7-2-1-3-8-15/h1-11,17H,12-13H2
InChI key:
BWFRTUNSGFBOLT-UHFFFAOYSA-N
SMILES:
ClC(Cl)(Cl)COC(=O)N1C=Cc2ccccc2C1CC(=O)c1ccccc1
Systematic name (3):
1-フェナシルイソキノリン-2(1H)-カルボン酸2,2,2-トリクロロエチル
2,2,2-トリクロロエチル 1-(2-オキソ-2-フェニルエチル)-1,2-ジヒドロイソキノリン-2-カルボキシラート
2,2,2-trichloroethyl 1-(2-oxo-2-phenylethyl)-1,2-dihydroisoquinoline-2-carboxylate
Other name (1):
1-Phenacylisoquinoline-2(1H)-carboxylic acid 2,2,2-trichloroethyl ester
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