Chem
J-GLOBAL ID:200907049144205030   Nikkaji number:J2.137.976J

N,N′-[(1R,2R)-1-[4-[4-(4-Ethenylphenyl)butoxy]phenyl]-2-(4-hydroxyphenyl)ethylene]bis(carbamic acid tert-butyl) ester

N,N′-[(1R,2R)-1-[4-[4-(4-エテニルフェニル)ブトキシ]フェニル]-2-(4-ヒドロキシフェニル)エチレン]ビス(カルバミド酸tert-ブチル)
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: C36H46N2O6
Molecular formula furigana: C36-H46-N2-O6
Molecular weight: 602.772
InChI: InChI=1S/C36H46N2O6/c1-8-25-12-14-26(15-13-25)11-9-10-24-42-30-22-18-28(19-23-30)32(38-34(41)44-36(5,6)7)31(27-16-20-29(39)21-17-27)37-33(40)43-35(2,3)4/h8,12-23,31-32,39H,1,9-11,24H2,2-7H3,(H,37,40)(H,38,41)/t31-,32-/m1/s1
InChI key: QRZMEIPDFRGUJA-ROJLCIKYSA-N
SMILES: CC(C)(C)OC(=O)N[C@@H]([C@H](NC(=O)OC(C)(C)C)c1ccc(OCCCCc2ccc(C=C)cc2)cc1)c1ccc(O)cc1
Systematic name  (3):
  • N,N′-[(1R,2R)-1-[4-[4-(4-エテニルフェニル)ブトキシ]フェニル]-2-(4-ヒドロキシフェニル)エチレン]ビス(カルバミド酸tert-ブチル)
  • tert-ブチル N-[(1R,2R)-2-{[(tert-ブトキシ)カルボニル]アミノ}-2-{4-[4-(4-エテニルフェニル)ブトキシ]フェニル}-1-(4-ヒドロキシフェニル)エチル]カルバマート
  • tert-butyl N-[(1R,2R)-2-{[(tert-butoxy)carbonyl]amino}-2-{4-[4-(4-ethenylphenyl)butoxy]phenyl}-1-(4-hydroxyphenyl)ethyl]carbamate
Other name (1):
  • N,N′-[(1R,2R)-1-[4-[4-(4-Ethenylphenyl)butoxy]phenyl]-2-(4-hydroxyphenyl)ethylene]bis(carbamic acid tert-butyl) ester
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