N-(3-chloranyl-4-fluoranyl-phenyl)-2-nitro-benzo[b][1]benzoxepine-4-carboxamide

SpectraBase Compound ID	2wKH6NdbDgo
InChI	InChI=1S/C21H12ClFN2O4/c22-17-9-13(6-8-18(17)23)24-21(26)16-10-14(25(27)28)11-20-15(16)7-5-12-3-1-2-4-19(12)29-20/h1-11H,(H,24,26)
InChIKey	NBJODVUZTUSCMC-UHFFFAOYSA-N Google Search
Mol Weight	410.79 g/mol
Molecular Formula	C21H12ClFN2O4
Exact Mass	410.046963 g/mol

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SpectraBase Spectrum ID	8ITtaUrJCYw
Name	N-(3-chloranyl-4-fluoranyl-phenyl)-2-nitro-benzo[b][1]benzoxepine-4-carboxamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H12ClFN2O4
InChI	InChI=1S/C21H12ClFN2O4/c22-17-9-13(6-8-18(17)23)24-21(26)16-10-14(25(27)28)11-20-15(16)7-5-12-3-1-2-4-19(12)29-20/h1-11H,(H,24,26)
InChIKey	NBJODVUZTUSCMC-UHFFFAOYSA-N
Molecular Weight	410.788 g/mol
SMILES	N(C(c1c2c(Oc3c(C=C2)cccc3)cc(c1)N(=O)=O)=O)c1cc(c(cc1)F)Cl
SPLASH	splash10-02tc-5960100000-7550abc0e5a5d1044ee2
Synonyms	N-(3-chloro-4-fluoro-phenyl)-2-nitro-benzo[b][1]benzoxepin-4-carboxamide N-(3-chloro-4-fluoro-phenyl)-2-nitro-benzo[b][1]benzoxepine-4-carboxamide N-(3-chloro-4-fluorophenyl)-2-nitro-4-benzo[b][1]benzoxepincarboxamide N-(3-chloro-4-fluorophenyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
Wiley ID	1512212