Chem
J-GLOBAL ID：200907099995774638   Nikkaji number：J707.114K

2-[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonylamino]propanedioic acid

2-[[4-[ビス(2-クロロエチル)アミノ]フェノキシ]カルボニルアミノ]プロパン二酸
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： C14H16Cl2N2O6
Molecular formula furigana： C14-H16-CL2-N2-O6
Molecular weight： 379.190
InChI： InChI=1S/C14H16Cl2N2O6/c15-5-7-18(8-6-16)9-1-3-10(4-2-9)24-14(23)17-11(12(19)20)13(21)22/h1-4,11H,5-8H2,(H,17,23)(H,19,20)(H,21,22)
InChI key： FWKHAQPAAQMIFO-UHFFFAOYSA-N
SMILES： OC(=O)C(NC(=O)Oc1ccc(cc1)N(CCCl)CCCl)C(=O)O
Systematic name  (3)：
  • 2-[[4-[ビス(2-クロロエチル)アミノ]フェノキシ]カルボニルアミノ]プロパン二酸
  • 2-[({4-[ビス(2-クロロエチル)アミノ]フェノキシ}カルボニル)アミノ]プロパン二酸
  • 2-[({4-[bis(2-chloroethyl)amino]phenoxy}carbonyl)amino]propanedioic acid
Other name (1)：
  • 2-[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonylamino]propanedioic acid
Thsaurus map：
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