| SpectraBase Spectrum ID |
IGNxbYN3CSX |
| Name |
2,2,2-Trichloroethyl 7-[(methoxycarbonyl)amino]-8-oxo-3-[(phenylsulfanyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide |
| CAS Registry Number |
97609-92-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17Cl3N2O7S2 |
| InChI |
InChI=1S/C18H17Cl3N2O7S2/c1-29-17(26)22-12-14(24)23-13(16(25)30-9-18(19,20)21)10(8-32(27,28)15(12)23)7-31-11-5-3-2-4-6-11/h2-6,12,15H,7-9H2,1H3,(H,22,26) |
| InChIKey |
UJSQLBPLPZXAEH-UHFFFAOYSA-N |
| Molecular Weight |
543.820 g/mol |
| SMILES |
N(C1C2N(C1=O)C(=C(CS2(=O)=O)CSc1ccccc1)C(=O)OCC(Cl)(Cl)Cl)C(=O)OC |
| SPLASH |
splash10-0a4l-0913200000-5f150b12a05ecdf1908d |
| Source of Spectrum |
W5-1989-38580-26956 |
| Synonyms |
2,2,2-Trichloroethyl 7-methoxycarbonylamino-3-phenylthiomethyl-3-cephem-4-carboxylate 1,1-dioxide
7-(methoxycarbonylamino)-5,5,8-trioxo-3-[(phenylthio)methyl]-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 2,2,2-trichloroethyl ester
2,2,2-trichloroethyl 7-(methoxycarbonylamino)-5,5,8-trioxo-3-(phenylsulfanylmethyl)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
2,2,2-tris(chloranyl)ethyl 7-(methoxycarbonylamino)-5,5,8-tris(oxidanylidene)-3-(phenylsulfanylmethyl)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
| Wiley ID |
1404782 |
![2,2,2-Trichloroethyl 7-[(methoxycarbonyl)amino]-8-oxo-3-[(phenylsulfanyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide](/api/spectrum/IGNxbYN3CSX/structure.png?h=300&w=458 "2,2,2-Trichloroethyl 7-[(methoxycarbonyl)amino]-8-oxo-3-[(phenylsulfanyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide")
