Chem
J-GLOBAL ID：201507021112451566   Nikkaji number：J3.413.995D

6-[4′-(2-Methylbutoxycarbonyl)biphenyl-4-yloxy]hexanoic acid 4-[(4-chlorophenylimino)methyl]phenyl ester

6-[4′-(2-メチルブトキシカルボニル)ビフェニル-4-イルオキシ]ヘキサン酸4-[(4-クロロフェニルイミノ)メチル]フェニル
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： C37H38ClNO5
Molecular formula furigana： C37-H38-CL-N-O5
Molecular weight： 612.160
InChI： InChI=1S/C37H38ClNO5/c1-3-27(2)26-43-37(41)31-12-10-29(11-13-31)30-14-22-34(23-15-30)42-24-6-4-5-7-36(40)44-35-20-8-28(9-21-35)25-39-33-18-16-32(38)17-19-33/h8-23,25,27H,3-7,24,26H2,1-2H3
InChI key： QFLAHRSSJPGNHK-UHFFFAOYSA-N
SMILES： CCC(C)COC(=O)c1ccc(cc1)c1ccc(OCCCCCC(=O)Oc2ccc(C=Nc3ccc(Cl)cc3)cc2)cc1
Systematic name  (3)：
  • 6-[4′-(2-メチルブトキシカルボニル)ビフェニル-4-イルオキシ]ヘキサン酸4-[(4-クロロフェニルイミノ)メチル]フェニル
  • 2-メチルブチル 4'-{[6-(4-{[(4-クロロフェニル)イミノ]メチル}フェノキシ)-6-オキソヘキシル]オキシ}-[1,1'-ビフェニル]-4-カルボキシラート
  • 2-methylbutyl 4'-{[6-(4-{[(4-chlorophenyl)imino]methyl}phenoxy)-6-oxohexyl]oxy}-[1,1'-biphenyl]-4-carboxylate
Other name (1)：
  • 6-[4′-(2-Methylbutoxycarbonyl)biphenyl-4-yloxy]hexanoic acid 4-[(4-chlorophenylimino)methyl]phenyl ester
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