basic_info |
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| Product_Name: | 1H-PYRROLE-3-CARBOXYLIC ACID, 5-(4-FLUOROPHENYL)-1-[[4-(TRIFLUOROMETHYL)PHENYL]SULFONYL]-, ETHYL ESTER |
| CAS: | 881673-57-0 |
| EnglishSynonyms: | 5-(4-FLUOROPHENYL)-1-[[4-(TRIFLUOROMETHYL)PHENYL]SULFONYL]-1H-PYRROLE-3-CARBOXYLIC ACID ETHYL ESTER ; 1H-PYRROLE-3-CARBOXYLIC ACID, 5-(4-FLUOROPHENYL)-1-[[4-(TRIFLUOROMETHYL)PHENYL]SULFONYL]-, ETHYL ESTER |
| pro_mdlNumber: | MFCD11875797 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | CCOC(=O)c1cc(n(c1)S(=O)(=O)c2ccc(cc2)C(F)(F)F)c3ccc(cc3)F |
| InChi: | InChI=1S/C20H15F4NO4S/c1-2-29-19(26)14-11-18(13-3-7-16(21)8-4-13)25(12-14)30(27,28)17-9-5-15(6-10-17)20(22,23)24/h3-12H,2H2,1H3 |
| InChiKey: | InChIKey=VAHRWQNPRQTPDP-UHFFFAOYSA-N |
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