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2,1-Benzisoxazole-6-carboxamide, N-(2'-benzoyl-5'-carboxyl-4'-chlorophenyl)-5-chloro-3-phenyl-
SpectraBase Compound ID LeVRU5x2PRn
InChI InChI=1S/C28H16Cl2N2O5/c29-21-12-20-24(32-37-26(20)16-9-5-2-6-10-16)13-17(21)27(34)31-23-14-18(28(35)36)22(30)11-19(23)25(33)15-7-3-1-4-8-15/h1-14H,(H,31,34)(H,35,36)
InChIKey CSABDTRYSLNFJE-UHFFFAOYSA-N
Mol Weight 531.35 g/mol
Molecular Formula C28H16Cl2N2O5
Exact Mass 530.043627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID La0ezLX2f0g
Name 2,1-Benzisoxazole-6-carboxamide, N-(2'-benzoyl-5'-carboxyl-4'-chlorophenyl)-5-chloro-3-phenyl-
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Formula C28H16Cl2N2O5
InChI InChI=1S/C28H16Cl2N2O5/c29-21-12-20-24(32-37-26(20)16-9-5-2-6-10-16)13-17(21)27(34)31-23-14-18(28(35)36)22(30)11-19(23)25(33)15-7-3-1-4-8-15/h1-14H,(H,31,34)(H,35,36)
InChIKey CSABDTRYSLNFJE-UHFFFAOYSA-N
Molecular Weight 531.351 g/mol
SMILES N(C(c1cc2c(cc1Cl)c(-c1ccccc1)on2)=O)c1cc(C(=O)O)c(cc1C(c1ccccc1)=O)Cl
SPLASH splash10-0a4i-3590020000-2cea4b7f7b810992e6d9
Synonyms 2-Chloranyl-5-[(5-chloranyl-3-phenyl-2,1-benzoxazol-6-yl)carbonylamino]-4-(phenylcarbonyl)benzoic acid 4-Benzoyl-2-chloro-5-([(5-chloro-3-phenyl-2,1-benzisoxazol-6-yl)carbonyl]amino)benzoic acid 4-Benzoyl-2-chloro-5-[(5-chloro-3-phenyl-2,1-benzoxazole-6-carbonyl)amino]benzoic acid 4-Benzoyl-2-chloro-5-[(5-chloro-3-phenyl-anthranil-6-carbonyl)amino]benzoic acid 4-Benzoyl-2-chloro-5-[[(5-chloro-3-phenyl-2,1-benzoxazol-6-yl)-oxomethyl]amino]benzoic acid
Wiley ID 1490369