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Ethyl-phenethyl-1,4-dihydro-2,6-dimethyl-4-[4-(5)-chloro-2-ethyl-5-(4)-imidazolyl]-3,5-pyridinedicarboxylate
SpectraBase Compound ID DxYMkUEtwym
InChI InChI=1S/C24H28ClN3O4/c1-5-17-27-21(22(25)28-17)20-18(23(29)31-6-2)14(3)26-15(4)19(20)24(30)32-13-12-16-10-8-7-9-11-16/h7-11,20,26H,5-6,12-13H2,1-4H3,(H,27,28)
InChIKey SAVFMBZEVLXPHF-UHFFFAOYSA-N
Mol Weight 457.96 g/mol
Molecular Formula C24H28ClN3O4
Exact Mass 457.176834 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxMiEwxIT9u
Name Ethyl-phenethyl-1,4-dihydro-2,6-dimethyl-4-[4-(5)-chloro-2-ethyl-5-(4)-imidazolyl]-3,5-pyridinedicarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.176834090 u
Formula C24H28ClN3O4
InChI InChI=1S/C24H28ClN3O4/c1-5-17-27-21(22(25)28-17)20-18(23(29)31-6-2)14(3)26-15(4)19(20)24(30)32-13-12-16-10-8-7-9-11-16/h7-11,20,26H,5-6,12-13H2,1-4H3,(H,27,28)
InChIKey SAVFMBZEVLXPHF-UHFFFAOYSA-N
Molecular Weight 457.958 g/mol
SMILES C1(=C(NC(=C(C1C=1N=C(CC)NC1Cl)C(=O)OCC)C)C)C(=O)OCCC1=CC=CC=C1