Chem
J-GLOBAL ID:201107063405920190   Nikkaji number:J2.956.650J

Dodecanoic acid (1R,2R)-1-(4-nitrophenyl)-2-[(dichloroacetyl)amino]-3-hydroxypropyl ester

ドデカン酸(1R,2R)-1-(4-ニトロフェニル)-2-[(ジクロロアセチル)アミノ]-3-ヒドロキシプロピル
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: C23H34Cl2N[N+]O5[O-]
Molecular formula furigana: C23-H34-CL2-N2-O6
Molecular weight: 505.430
InChI: InChI=1S/C23H34Cl2N2O6/c1-2-3-4-5-6-7-8-9-10-11-20(29)33-21(19(16-28)26-23(30)22(24)25)17-12-14-18(15-13-17)27(31)32/h12-15,19,21-22,28H,2-11,16H2,1H3,(H,26,30)/t19-,21-/m1/s1
InChI key: OAAQOZLLMSMJEG-TZIWHRDSSA-N
SMILES: CCCCCCCCCCCC(=O)O[C@@H]([C@@H](CO)NC(=O)C(Cl)Cl)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3):
  • ドデカン酸(1R,2R)-1-(4-ニトロフェニル)-2-[(ジクロロアセチル)アミノ]-3-ヒドロキシプロピル
  • (1R,2R)-2-(2,2-ジクロロアセトアミド)-3-ヒドロキシ-1-(4-ニトロフェニル)プロピル ドデカノアート
  • (1R,2R)-2-(2,2-dichloroacetamido)-3-hydroxy-1-(4-nitrophenyl)propyl dodecanoate
Other name (1):
  • Dodecanoic acid (1R,2R)-1-(4-nitrophenyl)-2-[(dichloroacetyl)amino]-3-hydroxypropyl ester
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