basic_info |
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| Product_Name: | (3AS,4R,9BR)-8-BROMO-4-(4-METHOXY-3-NITROPHENYL)-3A,4,5,9B-TETRAHYDRO-3H-CYCLOPENTA[C]QUINOLINE-6-CARBOXYLIC ACID |
| EnglishSynonyms: | (3AS,4R,9BR)-8-BROMO-4-(4-METHOXY-3-NITROPHENYL)-3A,4,5,9B-TETRAHYDRO-3H-CYCLOPENTA[C]QUINOLINE-6-CARBOXYLIC ACID |
| pro_mdlNumber: | MFCD02139092 |
| pro_acceptors: | 7 |
| pro_donors: | 2 |
| pro_smile: | COc1ccc(cc1[N+](=O)[O-])[C@H]2[C@H]3CC=C[C@H]3c4cc(cc(c4N2)C(=O)O)Br |
| InChi: | InChI=1S/C20H17BrN2O5/c1-28-17-6-5-10(7-16(17)23(26)27)18-13-4-2-3-12(13)14-8-11(21)9-15(20(24)25)19(14)22-18/h2-3,5-9,12-13,18,22H,4H2,1H3,(H,24,25)/t12-,13+,18+/m1/s1 |
| InChiKey: | InChIKey=ZCCVVBSJCURFSI-VBHSOAQHSA-N |
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