basic_info |
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| Product_Name: | 2-(3-CARBOXY-PHENYL)-PYRROLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER |
| CAS: | 669713-97-7 |
| EnglishSynonyms: | 2-(3-CARBOXY-PHENYL)-PYRROLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER ; 3-(2'-N-BOC-PYRROLE)BENZOIC ACID ; 1H-PYRROLE-1-CARBOXYLIC ACID, 2-(3-CARBOXYPHENYL)-, 1-(1,1-DIMETHYLETHYL) ESTER |
| pro_mdlNumber: | MFCD03426517 |
| pro_acceptors: | 5 |
| pro_donors: | 1 |
| pro_smile: | CC(C)(C)OC(=O)n1cccc1c2cccc(c2)C(=O)O |
| InChi: | InChI=1S/C16H17NO4/c1-16(2,3)21-15(20)17-9-5-8-13(17)11-6-4-7-12(10-11)14(18)19/h4-10H,1-3H3,(H,18,19) |
| InChiKey: | InChIKey=NHZAONBMGJNOGP-UHFFFAOYSA-N |
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