basic_info |
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| Product_Name: | 5-PHENYL-3-ETHYL-2-(2-METHYL-3-(5-PHENYL-3-ETHYL-2,3-DIHYDRO-BENZOXAZOL-2-YLIDENE)-1-PROPENYL)-BENZOXAZOLIUM ETHYLSULFATE |
| CAS: | 82557-14-0 |
| EnglishSynonyms: | 5-PHENYL-3-ETHYL-2-(2-METHYL-3-(5-PHENYL-3-ETHYL-2,3-DIHYDRO-BENZOXAZOL-2-YLIDENE)-1-PROPENYL)-BENZOXAZOLIUM ETHYLSULFATE |
| pro_mdlNumber: | MFCD00143485 |
| pro_acceptors: | 4 |
| pro_donors: | 0 |
| pro_smile: | CC[n+]1c2cc(ccc2oc1/C=C(\C)/C=C\3/N(c4cc(ccc4O3)c5ccccc5)CC)c6ccccc6.CCOS(=O)(=O)[O-] |
| InChi: | InChI=1S/C34H31N2O2.C2H6O4S/c1-4-35-29-22-27(25-12-8-6-9-13-25)16-18-31(29)37-33(35)20-24(3)21-34-36(5-2)30-23-28(17-19-32(30)38-34)26-14-10-7-11-15-26;1-2-6-7(3,4)5/h6-23H,4-5H2,1-3H3;2H2,1H3,(H,3,4,5)/q+1;/p-1 |
| InChiKey: | InChIKey=PMKKELNPZHFIDY-UHFFFAOYSA-M |
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