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2,1-Benzisoxazole-6-carboxamide, N-(2'-benzoylphenyl)-5-chloro-3-phenyl-
SpectraBase Compound ID DUZTlMONgw6
InChI InChI=1S/C27H17ClN2O3/c28-22-15-21-24(30-33-26(21)18-11-5-2-6-12-18)16-20(22)27(32)29-23-14-8-7-13-19(23)25(31)17-9-3-1-4-10-17/h1-16H,(H,29,32)
InChIKey KBYMCLWRVZOMMP-UHFFFAOYSA-N
Mol Weight 452.9 g/mol
Molecular Formula C27H17ClN2O3
Exact Mass 452.09277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3xvOMXdQ
Name 2,1-Benzisoxazole-6-carboxamide, N-(2'-benzoylphenyl)-5-chloro-3-phenyl-
CAS Registry Number 164936-94-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H17ClN2O3
InChI InChI=1S/C27H17ClN2O3/c28-22-15-21-24(30-33-26(21)18-11-5-2-6-12-18)16-20(22)27(32)29-23-14-8-7-13-19(23)25(31)17-9-3-1-4-10-17/h1-16H,(H,29,32)
InChIKey KBYMCLWRVZOMMP-UHFFFAOYSA-N
Molecular Weight 452.897 g/mol
SMILES N(C(c1cc2c(cc1Cl)c(-c1ccccc1)on2)=O)c1ccccc1C(c1ccccc1)=O
SPLASH splash10-0a4i-3982300000-53bcd9e693dea49380a9
Synonyms 5-Chloranyl-3-phenyl-N-[2-(phenylcarbonyl)phenyl]-2,1-benzoxazole-6-carboxamide N-(2-Benzoylphenyl)-5-chloro-3-phenyl-2,1-benzisoxazole-6-carboxamide N-(2-benzoylphenyl)-5-chloro-3-phenyl-2,1-benzoxazole-6-carboxamide N-(2-benzoylphenyl)-5-chloro-3-phenyl-anthranil-6-carboxamide
Wiley ID 1490467