| SpectraBase Spectrum ID |
sGcpWtYS1x |
| Name |
2-[4-(N-acetyl-2-iodo-anilino)but-2-ynyl]-2-[4-(diethylamino)but-2-ynyl]malonic acid diethyl ester |
| Alternate Name(s) |
2-[4-(N-acetyl-2-iodoanilino)but-2-ynyl]-2-[4-(diethylamino)but-2-ynyl]propanedioic acid diethyl ester
Diethyl 2-[4-(diethylamino)but-2-ynyl]-2-[4-[ethanoyl-(2-iodanylphenyl)amino]but-2-ynyl]propanedioate
Diethyl 2-[4-(N-acetyl-2-iodo-anilino)but-2-ynyl]-2-[4-(diethylamino)but-2-ynyl]propanedioate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H35IN2O5 |
| InChI |
InChI=1S/C27H35IN2O5/c1-6-29(7-2)20-14-12-18-27(25(32)34-8-3,26(33)35-9-4)19-13-15-21-30(22(5)31)24-17-11-10-16-23(24)28/h10-11,16-17H,6-9,18-21H2,1-5H3 |
| InChIKey |
MXLGBGCOXFFTCM-UHFFFAOYSA-N |
| Molecular Weight |
594.490 g/mol |
| SMILES |
C(C(=O)OCC)(C(=O)OCC)(CC#CCN(c1c(I)cccc1)C(=O)C)CC#CCN(CC)CC |
| SPLASH |
splash10-025c-9315010000-04fb0169b33dbf8f20eb |
| Source of Spectrum |
F-52-11493-23 |
| Wiley ID |
798370 |
![2-[4-(N-acetyl-2-iodo-anilino)but-2-ynyl]-2-[4-(diethylamino)but-2-ynyl]malonic acid diethyl ester](/api/spectrum/sGcpWtYS1x/structure.png?h=300&w=458 "2-[4-(N-acetyl-2-iodo-anilino)but-2-ynyl]-2-[4-(diethylamino)but-2-ynyl]malonic acid diethyl ester")
