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3-ETHYL-5-METHYL-2-[[2-(4-BROMOPHENYLSULFONAMIDO)-ETHOXY]-METHYL]-4-(2-CHLOROPHENYL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
SpectraBase Compound ID KNCFAHn0Lq2
InChI InChI=1S/C26H28BrClN2O7S/c1-4-37-26(32)24-21(15-36-14-13-29-38(33,34)18-11-9-17(27)10-12-18)30-16(2)22(25(31)35-3)23(24)19-7-5-6-8-20(19)28/h5-12,23,29-30H,4,13-15H2,1-3H3
InChIKey KGQIPYBLZIAVPR-UHFFFAOYSA-N
Mol Weight 627.93 g/mol
Molecular Formula C26H28BrClN2O7S
Exact Mass 626.048913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59T1QNXx5tM
Name 3-ETHYL-5-METHYL-2-[[2-(4-BROMOPHENYLSULFONAMIDO)-ETHOXY]-METHYL]-4-(2-CHLOROPHENYL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28BrClN2O7S
InChI InChI=1S/C26H28BrClN2O7S/c1-4-37-26(32)24-21(15-36-14-13-29-38(33,34)18-11-9-17(27)10-12-18)30-16(2)22(25(31)35-3)23(24)19-7-5-6-8-20(19)28/h5-12,23,29-30H,4,13-15H2,1-3H3
InChIKey KGQIPYBLZIAVPR-UHFFFAOYSA-N
Literature Reference Author V.L.R.SANA,V.R.KATLA,S.CHENNAMSETTY,A.SHAIK,N.R.CHAMARTHI
Literature Reference Citation D.PHARM.SINICA,4,10(2013)
Molecular Weight 627.935 g/mol
Solvent CDCl3
Source File Reference UWLU78012