| SpectraBase Spectrum ID |
Hr3pNQKVi37 |
| Name |
2-[(E)-(3-carbethoxy-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)iminomethyl]-4-nitro-phenolate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19N3O5S |
| InChI |
InChI=1S/C18H19N3O5S/c1-3-26-18(23)16-13-6-7-20(2)10-15(13)27-17(16)19-9-11-8-12(21(24)25)4-5-14(11)22/h4-5,8-9,22H,3,6-7,10H2,1-2H3/b19-9+ |
| InChIKey |
YTMDEIBVXUMKNK-DJKKODMXSA-N |
| Molecular Weight |
389.426 g/mol |
| SMILES |
Oc1c(\C=N\c2c(c3CCN(Cc3s2)C)C(=O)OCC)cc(N(=O)=O)cc1 |
| SPLASH |
splash10-000f-2953000000-3be8444be018047e2a65 |
| Synonyms |
2-[(E)-(3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)iminomethyl]-4-nitro-phenolate |
| Wiley ID |
1453861 |
![2-[(E)-(3-carbethoxy-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)iminomethyl]-4-nitro-phenolate](/api/spectrum/Hr3pNQKVi37/structure.png?h=300&w=458 "2-[(E)-(3-carbethoxy-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)iminomethyl]-4-nitro-phenolate")
