2-[(4-Chlorophenyl)(6-oxocyclohex-1-enyl)methyl]4-methylbenzenesulfonamide

SpectraBase Compound ID	Gz3u6ViFKWi
InChI	InChI=1S/C20H20ClNO3S/c1-13-6-11-19(26(22,24)25)17(12-13)20(14-7-9-15(21)10-8-14)16-4-2-3-5-18(16)23/h4,6-12,20H,2-3,5H2,1H3,(H2,22,24,25)
InChIKey	NIOOVBMKEPZBJY-UHFFFAOYSA-N Google Search
Mol Weight	389.9 g/mol
Molecular Formula	C20H20ClNO3S
Exact Mass	389.085242 g/mol

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SpectraBase Spectrum ID	5soPREeD374
Name	2-[(4-Chlorophenyl)(6-oxocyclohex-1-enyl)methyl]4-methylbenzenesulfonamide
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H20ClNO3S
InChI	InChI=1S/C20H20ClNO3S/c1-13-6-11-19(26(22,24)25)17(12-13)20(14-7-9-15(21)10-8-14)16-4-2-3-5-18(16)23/h4,6-12,20H,2-3,5H2,1H3,(H2,22,24,25)
InChIKey	NIOOVBMKEPZBJY-UHFFFAOYSA-N
Molecular Weight	389.897 g/mol
SMILES	NS(c1c(C(C=2C(=O)CCCC2)c2ccc(cc2)Cl)cc(cc1)C)(=O)=O
SPLASH	splash10-001i-0090000000-3596c507c1bd59726941
Source of Spectrum	U1-2002-3674-4
Synonyms	2-[(4-chlorophenyl)(6-oxo-1-cyclohexen-1-yl)methyl]-4-methylbenzenesulfonamide
Wiley ID	1523422