Chem
J-GLOBAL ID：201707021375222329   Nikkaji number：J3.585.962D

4-(4-(4-(4-Nitrobenzoylmethylamino)benzoylmethylamino)benzoylmethylamino)benzoic acid methyl ester

4-(4-(4-(4-ニトロベンゾイルメチルアミノ)ベンゾイルメチルアミノ)ベンゾイルメチルアミノ)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： C32H28N3[N+]O6[O-]
Molecular formula furigana： C32-H28-N4-O7
Molecular weight： 580.597
InChI： InChI=1S/C32H28N4O7/c1-33(25-13-7-22(8-14-25)30(38)35(3)27-17-11-24(12-18-27)32(40)43-4)29(37)21-5-15-26(16-6-21)34(2)31(39)23-9-19-28(20-10-23)36(41)42/h5-20H,1-4H3
InChI key： LRNFCYDYDPDLDI-UHFFFAOYSA-N
SMILES： COC(=O)c1ccc(cc1)N(C)C(=O)c1ccc(cc1)N(C)C(=O)c1ccc(cc1)N(C)C(=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • 4-(4-(4-(4-ニトロベンゾイルメチルアミノ)ベンゾイルメチルアミノ)ベンゾイルメチルアミノ)安息香酸メチル
  • メチル 4-{N-メチル4-[N-メチル4-(N-メチル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-methyl4-[N-methyl4-(N-methyl4-nitrobenzamido)benzamido]benzamido}benzoate
Other name (1)：
  • 4-(4-(4-(4-Nitrobenzoylmethylamino)benzoylmethylamino)benzoylmethylamino)benzoic acid methyl ester
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