Methyl 3-Hydroxy-6-[(4-nitrophenyl)sulfanyl]-4-pentyl-1,1'-biphenyl-2-carboxylate

SpectraBase Compound ID	1xV7VUbIoU8
InChI	InChI=1S/C25H25NO5S/c1-3-4-6-11-18-16-21(32-20-14-12-19(13-15-20)26(29)30)22(17-9-7-5-8-10-17)23(24(18)27)25(28)31-2/h5,7-10,12-16,27H,3-4,6,11H2,1-2H3
InChIKey	FMAZCHHREWOCAK-UHFFFAOYSA-N Google Search
Mol Weight	451.54 g/mol
Molecular Formula	C25H25NO5S
Exact Mass	451.145344 g/mol

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SpectraBase Spectrum ID	1UTCibUYE70
Name	Methyl 3-Hydroxy-6-[(4-nitrophenyl)sulfanyl]-4-pentyl-1,1'-biphenyl-2-carboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H25NO5S
InChI	InChI=1S/C25H25NO5S/c1-3-4-6-11-18-16-21(32-20-14-12-19(13-15-20)26(29)30)22(17-9-7-5-8-10-17)23(24(18)27)25(28)31-2/h5,7-10,12-16,27H,3-4,6,11H2,1-2H3
InChIKey	FMAZCHHREWOCAK-UHFFFAOYSA-N
Molecular Weight	451.537 g/mol
SMILES	Oc1c(C(=O)OC)c(-c2ccccc2)c(Sc2ccc(cc2)[N+](=O)[O-])cc1CCCCC
SPLASH	splash10-0pvi-0064900000-6b395699fc860c68a06e
Source of Spectrum	H-93-1619-5l
Synonyms	Methyl 3-hydroxy-6-((4-nitrophenyl)thio)-4-pentyl-[1,1'-biphenyl]-2-carboxylate
Wiley ID	1784062