| SpectraBase Spectrum ID |
4WDRG3BmDXe |
| Name |
2,3-Dimethyl 6-amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-1-phenyl-1,4-dihydropyridine-2,3-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.143035402 u |
| Formula |
C23H21N3O6 |
| InChI |
InChI=1S/C23H21N3O6/c1-30-17-11-13(9-10-16(17)27)18-15(12-24)21(25)26(14-7-5-4-6-8-14)20(23(29)32-3)19(18)22(28)31-2/h4-11,18,27H,25H2,1-3H3 |
| InChIKey |
SDICQYYTAPRAMX-UHFFFAOYSA-N |
| Molecular Weight |
435.436 g/mol |
| SMILES |
C1(=C(N(C=2C=CC=CC2)C(=C(C1C1=CC(=C(O)C=C1)OC)C(=O)OC)C(=O)OC)N)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917131 |
