2-[[4-(p-tolylsulfonylamino)phenyl]carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid

SpectraBase Compound ID	9ymLZhScRyz
InChI	InChI=1S/C21H20N2O6S/c1-12-2-8-15(9-3-12)30(27,28)23-14-6-4-13(5-7-14)22-20(24)18-16-10-11-17(29-16)19(18)21(25)26/h2-11,16-19,23H,1H3,(H,22,24)(H,25,26)
InChIKey	KQWJDELWBIHFNL-UHFFFAOYSA-N Google Search
Mol Weight	428.46 g/mol
Molecular Formula	C21H20N2O6S
Exact Mass	428.104208 g/mol

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SpectraBase Spectrum ID	A9hPGBLJvNS
Name	2-[[4-(p-tolylsulfonylamino)phenyl]carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H20N2O6S
InChI	InChI=1S/C21H20N2O6S/c1-12-2-8-15(9-3-12)30(27,28)23-14-6-4-13(5-7-14)22-20(24)18-16-10-11-17(29-16)19(18)21(25)26/h2-11,16-19,23H,1H3,(H,22,24)(H,25,26)
InChIKey	KQWJDELWBIHFNL-UHFFFAOYSA-N
Molecular Weight	428.459 g/mol
SMILES	N(S(c1ccc(cc1)C)(=O)=O)c1ccc(NC(C2C(C(=O)O)C3OC2C=C3)=O)cc1
SPLASH	splash10-00kr-9200000000-d243b36468c5c333aa7c
Synonyms	2-[[4-(tosylamino)phenyl]carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid 2-[[4-[(4-methylphenyl)sulfonylamino]anilino]-oxomethyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid 2-[[4-[(4-methylphenyl)sulfonylamino]phenyl]carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
Wiley ID	1445479