Chem
J-GLOBAL ID:201207072787857708   Nikkaji number:J3.093.497K

1-Allyl-1-[3-(2-oxo-2-tert-butoxyethoxy)-5-isopropoxybenzoyl]-3-[2-(2-oxo-2-tert-butoxyethoxy)-6-isopropoxyphenyl]urea

1-アリル-1-[3-(2-オキソ-2-tert-ブトキシエトキシ)-5-イソプロポキシベンゾイル]-3-[2-(2-オキソ-2-tert-ブトキシエトキシ)-6-イソプロポキシフェニル]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: C35H48N2O10
Molecular formula furigana: C35-H48-N2-O10
Molecular weight: 656.773
InChI: InChI=1S/C35H48N2O10/c1-12-16-37(32(40)24-17-25(19-26(18-24)44-22(2)3)42-20-29(38)46-34(6,7)8)33(41)36-31-27(14-13-15-28(31)45-23(4)5)43-21-30(39)47-35(9,10)11/h12-15,17-19,22-23H,1,16,20-21H2,2-11H3,(H,36,41)
InChI key: KBQLUDINNDWLQR-UHFFFAOYSA-N
SMILES: CC(C)Oc1cc(OCC(=O)OC(C)(C)C)cc(c1)C(=O)N(CC=C)C(=O)Nc1c(OCC(=O)OC(C)(C)C)cccc1OC(C)C
Systematic name  (3):
  • 1-アリル-1-[3-(2-オキソ-2-tert-ブトキシエトキシ)-5-イソプロポキシベンゾイル]-3-[2-(2-オキソ-2-tert-ブトキシエトキシ)-6-イソプロポキシフェニル]尿素
  • tert-ブチル 2-(3-{[({2-[2-(tert-ブトキシ)-2-オキソエトキシ]-6-(プロパン-2-イルオキシ)フェニル}カルバモイル)(プロパ-2-エン-1-イル)アミノ]カルボニル}-5-(プロパン-2-イルオキシ)フェノキシ)アセタート
  • tert-butyl 2-(3-{[({2-[2-(tert-butoxy)-2-oxoethoxy]-6-(propan-2-yloxy)phenyl}carbamoyl)(prop-2-en-1-yl)amino]carbonyl}-5-(propan-2-yloxy)phenoxy)acetate
Other name (1):
  • 1-Allyl-1-[3-(2-oxo-2-tert-butoxyethoxy)-5-isopropoxybenzoyl]-3-[2-(2-oxo-2-tert-butoxyethoxy)-6-isopropoxyphenyl]urea
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