Chem
J-GLOBAL ID：200907089323751065   Nikkaji number：J390.162I

(1S)-1α-(Hydroxymethyl)-4α-[[(chloroacetylamino)carbonyl]amino]cyclopenta-2-ene

3-(2-クロロアセチル)-1-[(1R,4S)-4-(ヒドロキシメチル)シクロペンタ-2-エン-1-イル]尿素
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： C9H13ClN2O3
Molecular formula furigana： C9-H13-CL-N2-O3
Molecular weight： 232.660
InChI： InChI=1S/C9H13ClN2O3/c10-4-8(14)12-9(15)11-7-2-1-6(3-7)5-13/h1-2,6-7,13H,3-5H2,(H2,11,12,14,15)/t6-,7+/m1/s1
InChI key： HNBGUHGOPKDQET-RQJHMYQMSA-N
SMILES： OC[C@H]1C[C@@H](NC(=O)NC(=O)CCl)C=C1
Systematic name  (3)：
  • (1S)-1α-(ヒドロキシメチル)-4α-[[(クロロアセチルアミノ)カルボニル]アミノ]シクロペンタ-2-エン
  • 3-(2-クロロアセチル)-1-[(1R,4S)-4-(ヒドロキシメチル)シクロペンタ-2-エン-1-イル]尿素
  • 3-(2-chloroacetyl)-1-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]urea
Other name (1)：
  • (1S)-1α-(Hydroxymethyl)-4α-[[(chloroacetylamino)carbonyl]amino]cyclopenta-2-ene
Thsaurus map：
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