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METHYL-3-(4',5'-DIHYDRO-3'-(PARA-CHLOROPHENYL)-5'-(PARA-METHYLPHENYL)-ISOXAZOL-4'-YLSULFONYL)-4-(PARA-CHLOROPHENYL)-3H-PYRROLE-3-CARBOXYLATE

View entire compound with spectra: 1 NMR

METHYL-3-(4',5'-DIHYDRO-3'-(PARA-CHLOROPHENYL)-5'-(PARA-METHYLPHENYL)-ISOXAZOL-4'-YLSULFONYL)-4-(PARA-CHLOROPHENYL)-3H-PYRROLE-3-CARBOXYLATE
SpectraBase Compound ID 728Uk1pi5wt
InChI InChI=1S/C28H22Cl2N2O5S/c1-17-3-5-20(6-4-17)25-26(24(32-37-25)19-9-13-22(30)14-10-19)38(34,35)28(27(33)36-2)16-31-15-23(28)18-7-11-21(29)12-8-18/h3-16,25-26H,1-2H3
InChIKey DMGHWAYSCDIUEL-UHFFFAOYSA-N
Mol Weight 569.46 g/mol
Molecular Formula C28H22Cl2N2O5S
Exact Mass 568.062648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AimNC4OdN2j
Name METHYL-3-(4',5'-DIHYDRO-3'-(PARA-CHLOROPHENYL)-5'-(PARA-METHYLPHENYL)-ISOXAZOL-4'-YLSULFONYL)-4-(PARA-CHLOROPHENYL)-3H-PYRROLE-3-CARBOXYLATE
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H22Cl2N2O5S
InChI InChI=1S/C28H22Cl2N2O5S/c1-17-3-5-20(6-4-17)25-26(24(32-37-25)19-9-13-22(30)14-10-19)38(34,35)28(27(33)36-2)16-31-15-23(28)18-7-11-21(29)12-8-18/h3-16,25-26H,1-2H3
InChIKey DMGHWAYSCDIUEL-UHFFFAOYSA-N
Literature Reference Author V.PADMAVATHI,T.R.LAKSHMI,K.MAHESH,A.PADMAJA
Literature Reference Citation CHEM.PHARM.BULL.,57,1200(2009)
Literature Reference DOI 10.1248/cpb.57.1200
Molecular Weight 569.459 g/mol
Sample ID 3152
Solvent DMSO-D6