Chem
J-GLOBAL ID：201507056522361090   Nikkaji number：J3.371.620F

3-(tert-Butoxycarbonylamino)-2-[(E)-(triphenylphosphoranylideneamino)methylene]propanoic acid ethyl ester

3-(tert-ブトキシカルボニルアミノ)-2-[(E)-(トリフェニルホスホラニリデンアミノ)メチレン]プロパン酸エチル
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： C29H33N2O4P
Molecular formula furigana： C29-H33-N2-O4-P
Molecular weight： 504.567
InChI： InChI=1S/C29H33N2O4P/c1-5-34-27(32)23(21-30-28(33)35-29(2,3)4)22-31-36(24-15-9-6-10-16-24,25-17-11-7-12-18-25)26-19-13-8-14-20-26/h6-20,22H,5,21H2,1-4H3,(H,30,33)/b23-22+
InChI key： TUGDBOQRJUZXPD-GHVJWSGMSA-N
SMILES： CCOC(=O)/C(=C/N=P(c1ccccc1)(c1ccccc1)c1ccccc1)/CNC(=O)OC(C)(C)C
Systematic name  (3)：
  • 3-(tert-ブトキシカルボニルアミノ)-2-[(E)-(トリフェニルホスホラニリデンアミノ)メチレン]プロパン酸エチル
  • エチル (2E)-2-({[(tert-ブトキシ)カルボニル]アミノ}メチル)-3-[(トリフェニル-λ5-ホスファニリデン)アミノ]プロパ-2-エノアート
  • ethyl (2E)-2-({[(tert-butoxy)carbonyl]amino}methyl)-3-[(triphenyl-λ5-phosphanylidene)amino]prop-2-enoate
Other name (1)：
  • 3-(tert-Butoxycarbonylamino)-2-[(E)-(triphenylphosphoranylideneamino)methylene]propanoic acid ethyl ester
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