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benzoic acid, 2-[[4-[(2-bromobenzoyl)amino]benzoyl]amino]-
SpectraBase Compound ID 3g73zoNSSnP
InChI InChI=1S/C21H15BrN2O4/c22-17-7-3-1-5-15(17)20(26)23-14-11-9-13(10-12-14)19(25)24-18-8-4-2-6-16(18)21(27)28/h1-12H,(H,23,26)(H,24,25)(H,27,28)
InChIKey RYGMCQSOLWPVAN-UHFFFAOYSA-N
Mol Weight 439.27 g/mol
Molecular Formula C21H15BrN2O4
Exact Mass 438.02152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqlsTVWQsKN
Name 2-({4-[(2-bromobenzoyl)amino]benzoyl}amino)benzoic acid
Alternate Name(s) 2-[[[4-[[(2-bromophenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]benzoic acid 2-[[4-[(2-bromophenyl)carbonylamino]phenyl]carbonylamino]benzoic acid
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Formula C21H15BrN2O4
InChI InChI=1S/C21H15BrN2O4/c22-17-7-3-1-5-15(17)20(26)23-14-11-9-13(10-12-14)19(25)24-18-8-4-2-6-16(18)21(27)28/h1-12H,(H,23,26)(H,24,25)(H,27,28)
InChIKey RYGMCQSOLWPVAN-UHFFFAOYSA-N
Molecular Weight 439.265 g/mol
SMILES N(C(c1c(Br)cccc1)=O)c1ccc(C(Nc2c(C(=O)O)cccc2)=O)cc1
SPLASH splash10-00lg-7900000000-17314bf84b0d140d4748
Source of Spectrum IY-3-218-0
Wiley ID 1718166