CAS Registry Number®
103890-81-9
CAS Name
3-Ethyl 5-methyl 4-[2-[(1E)-3-(1,1-dimethylethoxy)-3-oxo-1-propen-1-yl]phenyl]-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate
Molecular Formula
C25H31NO6
Molecular Mass
441.52
Other Names and Identifiers
InChI
InChI=1/C25H31NO6/c1-8-31-24(29)21-16(3)26-15(2)20(23(28)30-7)22(21)18-12-10-9-11-17(18)13-14-19(27)32-25(4,5)6/h9-14,22,26H,8H2,1-7H3/b14-13+
InChIKey
InChIKey=MQLPBBLKDRVRCO-BUHFOSPRNA-N
SMILES
C(OCC)(=O)C=1C(C(C(OC)=O)=C(C)NC1C)C2=C(/C=C/C(OC(C)(C)C)=O)C=CC=C2
Canonical SMILES
O=C(OC(C)(C)C)C=CC=1C=CC=CC1C2C(C(=O)OC)=C(NC(=C2C(=O)OCC)C)C
Other Names for this Substance
- 3,5-Pyridinedicarboxylic acid, 4-[2-[(1E)-3-(1,1-dimethylethoxy)-3-oxo-1-propen-1-yl]phenyl]-1,4-dihydro-2,6-dimethyl-, 3-ethyl 5-methyl ester
- 3,5-Pyridinedicarboxylic acid, 4-[2-[3-(1,1-dimethylethoxy)-3-oxo-1-propenyl]phenyl]-1,4-dihydro-2,6-dimethyl-, ethyl methyl ester, (E)-
- 3-Ethyl 5-methyl 4-[2-[(1E)-3-(1,1-dimethylethoxy)-3-oxo-1-propen-1-yl]phenyl]-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate
