basic_info |
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| Product_Name: | 4-(2-CARBOXYPHENYL)-7-DIETHYLAMINO-2-(7-DIETHYLAMINO-2-OXOCHROMAN-3-YL)-CHROMYLIUM PERCHLORATE |
| CAS: | 168206-21-1 |
| EnglishSynonyms: | 4-(2-CARBOXYPHENYL)-7-DIETHYLAMINO-2-(7-DIETHYLAMINO-2-OXOCHROMAN-3-YL)-CHROMYLIUM PERCHLORATE |
| pro_mdlNumber: | MFCD06798192 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | CCN(CC)c1ccc2cc(c(=O)oc2c1)c3cc(c4ccc(cc4[o+]3)N(CC)CC)c5ccccc5C(=O)O.[O-]Cl(=O)(=O)=O |
| InChi: | InChI=1S/C33H32N2O5.ClHO4/c1-5-34(6-2)22-14-13-21-17-28(33(38)40-29(21)18-22)31-20-27(24-11-9-10-12-26(24)32(36)37)25-16-15-23(19-30(25)39-31)35(7-3)8-4;2-1(3,4)5/h9-20H,5-8H2,1-4H3;(H,2,3,4,5) |
| InChiKey: | InChIKey=VTMBPDDANDHVLA-UHFFFAOYSA-N |
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