Chem
J-GLOBAL ID：201707006234704452   Nikkaji number：J3.585.963B

4-(4-(4-(4-Nitrobenzoylpropylamino)benzoylpropylamino)benzoylpropylamino)benzoic acid methyl ester

4-(4-(4-(4-ニトロベンゾイルプロピルアミノ)ベンゾイルプロピルアミノ)ベンゾイルプロピルアミノ)安息香酸メチル
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： C38H40N3[N+]O6[O-]
Molecular formula furigana： C38-H40-N4-O7
Molecular weight： 664.759
InChI： InChI=1S/C38H40N4O7/c1-5-24-39(31-16-10-28(11-17-31)36(44)41(26-7-3)33-20-14-30(15-21-33)38(46)49-4)35(43)27-8-18-32(19-9-27)40(25-6-2)37(45)29-12-22-34(23-13-29)42(47)48/h8-23H,5-7,24-26H2,1-4H3
InChI key： KGZLYJGWQCESJS-UHFFFAOYSA-N
SMILES： CCCN(C(=O)c1ccc(cc1)N(CCC)C(=O)c1ccc(cc1)N(CCC)C(=O)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)C(=O)OC
Systematic name  (3)：
  • 4-(4-(4-(4-ニトロベンゾイルプロピルアミノ)ベンゾイルプロピルアミノ)ベンゾイルプロピルアミノ)安息香酸メチル
  • メチル 4-{N-プロピル4-[N-プロピル4-(N-プロピル4-ニトロベンズアミド)ベンズアミド]ベンズアミド}ベンゾアート
  • methyl 4-{N-propyl4-[N-propyl4-(N-propyl4-nitrobenzamido)benzamido]benzamido}benzoate
Other name (1)：
  • 4-(4-(4-(4-Nitrobenzoylpropylamino)benzoylpropylamino)benzoylpropylamino)benzoic acid methyl ester
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