Chem
J-GLOBAL ID:200907083577119883   Nikkaji number:J1.841.941F

(S)-2-(4,5,6,7-Tetrachlorophthalimidyl)-3,3-dimethylbutyric acid

(S)-2-(4,5,6,7-テトラクロロフタルイミジル)-3,3-ジメチル酪酸
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: C14H11Cl4NO4
Molecular formula furigana: C14-H11-CL4-N-O4
Molecular weight: 399.050
InChI: InChI=1S/C14H11Cl4NO4/c1-14(2,3)10(13(22)23)19-11(20)4-5(12(19)21)7(16)9(18)8(17)6(4)15/h10H,1-3H3,(H,22,23)/t10-/m1/s1
InChI key: CWXLTHUSLLBBCP-SNVBAGLBSA-N
SMILES: CC(C)(C)[C@H](N1C(=O)c2c(C1=O)c(Cl)c(Cl)c(Cl)c2Cl)C(=O)O
Systematic name  (21):
  • (S)-2-(4,5,6,7-テトラクロロフタルイミジル)-3,3-ジメチル酪酸
  • (2S)-2-[(1,3-ジオキソ-4,5,6,7-テトラクロロ-1,3-ジヒドロ-2H-イソインドール)-2-イル]-3,3-ジメチルブタン酸
  • (S)-2-(1,3-ジオキソ-4,5,6,7-テトラクロロイソインドリン-2-イル)-3,3-ジメチルブタン酸
  • (S)-2-(1,3-ジオキソ-4,5,6,7-テトラクロロ-1,3-ジヒドロ-2H-イソインドール-2-イル)-3,3-ジメチル酪酸
  • (2S)-2-[(4,5,6,7-テトラクロロ-1,3-ジオキソ-1,3-ジヒドロ-2H-イソインドール)-2-イル]-3,3-ジメチルブタン酸
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Other name (19):
  • (S)-2-(4,5,6,7-Tetrachlorophthalimidyl)-3,3-dimethylbutyric acid
  • (2S)-2-[(1,3-Dioxo-4,5,6,7-tetrachloro-1,3-dihydro-2H-isoindole)-2-yl]-3,3-dimethylbutanoic acid
  • (S)-2-(1,3-Dioxo-4,5,6,7-tetrachloroisoindoline-2-yl)-3,3-dimethylbutanoic acid
  • (S)-2-(1,3-Dioxo-4,5,6,7-tetrachloro-1,3-dihydro-2H-isoindole-2-yl)-3,3-dimethylbutyric acid
  • (2S)-2-[(4,5,6,7-Tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindole)-2-yl]-3,3-dimethylbutanoic acid
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