| SpectraBase Spectrum ID |
4mAOvZHP3ag |
| Name |
(3S,6R)-3-Ethyl-6-[methyl-(3-phenyl-propynoyl)-amino]-cyclohexa-1,4-diene-1,2-dicarboxylic acid dimethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H23NO5 |
| InChI |
InChI=1S/C22H23NO5/c1-5-16-12-13-17(20(22(26)28-4)19(16)21(25)27-3)23(2)18(24)14-11-15-9-7-6-8-10-15/h6-10,12-13,16-17H,5H2,1-4H3/t16-,17+/m0/s1 |
| InChIKey |
YAGLDFXUBAXVJS-DLBZAZTESA-N |
| Molecular Weight |
381.428 g/mol |
| SMILES |
C=1([C@](N(C(C#Cc2ccccc2)=O)C)(C=C[C@@](C1C(=O)OC)(CC)[H])[H])C(=O)OC |
| SPLASH |
splash10-004i-0912000000-c2563aa9c0a055bd64d8 |
| Source of Spectrum |
KC-61-11341-11 |
| Synonyms |
Dimethyl (3S,6R)-3-ethyl-6-[methyl(3-phenyl-2-propynoyl)amino]-1,4-cyclohexadiene-1,2-dicarboxylate
Dimethyl 3-(N-methyl-3-phenylpropiolamido)-6-ethylcyclohexa-1,4-diene-1,2-dicarboxylate |
| Wiley ID |
1631333 |
![(3S,6R)-3-Ethyl-6-[methyl-(3-phenyl-propynoyl)-amino]-cyclohexa-1,4-diene-1,2-dicarboxylic acid dimethyl ester](/api/spectrum/4mAOvZHP3ag/structure.png?h=300&w=458 "(3S,6R)-3-Ethyl-6-[methyl-(3-phenyl-propynoyl)-amino]-cyclohexa-1,4-diene-1,2-dicarboxylic acid dimethyl ester")
