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Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]-, 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl ester
SpectraBase Compound ID B9em7gcQxsc
InChI InChI=1S/C22H20ClN3O8S/c23-16-10-17(25-11-14-2-1-5-31-14)15(9-20(16)35(24,29)30)22(28)34-12-21(27)26-13-3-4-18-19(8-13)33-7-6-32-18/h1-5,8-10,25H,6-7,11-12H2,(H,26,27)(H2,24,29,30)
InChIKey GSGFCMJGYNNAMR-UHFFFAOYSA-N
Mol Weight 521.93 g/mol
Molecular Formula C22H20ClN3O8S
Exact Mass 521.065963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91VBsizriuq
Name Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]-, 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20ClN3O8S
InChI InChI=1S/C22H20ClN3O8S/c23-16-10-17(25-11-14-2-1-5-31-14)15(9-20(16)35(24,29)30)22(28)34-12-21(27)26-13-3-4-18-19(8-13)33-7-6-32-18/h1-5,8-10,25H,6-7,11-12H2,(H,26,27)(H2,24,29,30)
InChIKey GSGFCMJGYNNAMR-UHFFFAOYSA-N
Molecular Weight 521.928 g/mol
SMILES N(C(COC(c1c(cc(c(c1)S(=O)(=O)N)Cl)NCc1occc1)=O)=O)c1cc2OCCOc2cc1
SPLASH splash10-001i-9620000000-12ed4430f6921da219cf
Source of Spectrum IY-2-5051-6
Synonyms [(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]methyl 4-chloro-2-[(furan-2-ylmethyl)amino]-5-sulfamoylbenzoate 4-Chloro-2-(2-furanylmethylamino)-5-sulfamoylbenzoic acid [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] ester [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoate [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl] 4-chloro-2-(2-furylmethylamino)-5-sulfamoyl-benzoate [2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl] 4-chloranyl-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzoate
Wiley ID 1658499