3-[(2-Chloro-2-phenylethyl)sulfonyl]-N-(3-nitrophenyl)benzamide

SpectraBase Compound ID	5SDxgmvNDWL
InChI	InChI=1S/C21H17ClN2O5S/c22-20(15-6-2-1-3-7-15)14-30(28,29)19-11-4-8-16(12-19)21(25)23-17-9-5-10-18(13-17)24(26)27/h1-13,20H,14H2,(H,23,25)
InChIKey	CTNKOSRQVHPLPG-UHFFFAOYSA-N Google Search
Mol Weight	444.89 g/mol
Molecular Formula	C21H17ClN2O5S
Exact Mass	444.054671 g/mol

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SpectraBase Spectrum ID	376X9ZWOGps
Name	3-(beta-CHLOROPHENETHYLSULFONYL)-N-(3-NITROPHENYL)BENZAMIDE
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C21H17ClN2O5S
InChI	InChI=1S/C21H17ClN2O5S/c22-20(15-6-2-1-3-7-15)14-30(28,29)19-11-4-8-16(12-19)21(25)23-17-9-5-10-18(13-17)24(26)27/h1-13,20H,14H2,(H,23,25)
InChIKey	CTNKOSRQVHPLPG-UHFFFAOYSA-N
Molecular Weight	444.0543
SMILES	N(C(c1cc(S(CC(c2ccccc2)Cl)(=O)=O)ccc1)=O)c1cc(N(=O)=O)ccc1
SPLASH	splash10-0f79-9300000000-2af24ef4eb012829dd70
Source of Spectrum	Chemical Concepts, A Wiley Division, Weinheim, Germany