Chem
J-GLOBAL ID:200907058381577480
Nikkaji number:J1.459.286E
1-(3,4-Dimethoxybenzyl)-2-(trifluoroacetyl)-7-methoxy-8a-acetoxy-1,2,3,4-tetrahydroisoquinoline-6(8aH)-one
1-(3,4-ジメトキシベンジル)-2-(トリフルオロアセチル)-7-メトキシ-8a-アセトキシ-1,2,3,4-テトラヒドロイソキノリン-6(8aH)-オン
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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:
C23 H24 F3 NO7
Molecular formula furigana:
C23-H24-F3-N-O7
Molecular weight:
483.440
InChI:
InChI=1S/C23H24F3NO7/c1-13(28)34-22-12-19(33-4)16(29)11-15(22)7-8-27(21(30)23(24,25)26)20(22)10-14-5-6-17(31-2)18(9-14)32-3/h5-6,9,11-12,20H,7-8,10H2,1-4H3
InChI key:
GTSBIXZFMRVJGG-UHFFFAOYSA-N
SMILES:
COC1=CC2(OC(=O)C)C(Cc3ccc(OC)c(OC)c3)N(CCC2=CC1=O)C(=O)C(F)(F)F
Systematic name (3):
1-(3,4-ジメトキシベンジル)-2-(トリフルオロアセチル)-7-メトキシ-8a-アセトキシ-1,2,3,4-テトラヒドロイソキノリン-6(8aH)-オン
1-[(3,4-ジメトキシフェニル)メチル]-7-メトキシ-6-オキソ-2-(2,2,2-トリフルオロアセチル)-1,2,3,4,6,8a-ヘキサヒドロイソキノリン-8a-イル アセタート
1-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-6-oxo-2-(2,2,2-trifluoroacetyl)-1,2,3,4,6,8a-hexahydroisoquinolin-8a-yl acetate
Other name (1):
1-(3,4-Dimethoxybenzyl)-2-(trifluoroacetyl)-7-methoxy-8a-acetoxy-1,2,3,4-tetrahydroisoquinoline-6(8aH)-one
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