basic_info |
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Product_Name: | 1-BUTYL-2-((E)-2-((3E)-3-[(2Z)-2-(1-BUTYL-3,3-DIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)ETHYLIDENE]-2-[(4-METHYLPHENYL)AMINO]CYCLOPENT-1-EN-1-YL)VINYL)-3,3-DIMETHYL-3H-INDOLIUM TETRAFLUOROBORATE |
EnglishSynonyms: | 1-BUTYL-2-((E)-2-((3E)-3-[(2Z)-2-(1-BUTYL-3,3-DIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)ETHYLIDENE]-2-[(4-METHYLPHENYL)AMINO]CYCLOPENT-1-EN-1-YL)VINYL)-3,3-DIMETHYL-3H-INDOLIUM TETRAFLUOROBORATE |
pro_mdlNumber: | MFCD12031651 |
pro_acceptors: | 3 |
pro_donors: | 1 |
pro_smile: | [B-](F)(F)(F)F.CCCCN\1c2ccccc2C(/C1=C/C=C/3\CCC(=C3Nc4ccc(cc4)C)/C=C/C5=[N+](c6ccccc6C5(C)C)CCCC)(C)C |
InChi: | InChI=1S/C44H53N3.BF4/c1-8-10-30-46-38-18-14-12-16-36(38)43(4,5)40(46)28-24-33-22-23-34(42(33)45-35-26-20-32(3)21-27-35)25-29-41-44(6,7)37-17-13-15-19-39(37)47(41)31-11-9-2;2-1(3,4)5/h12-21,24-29H,8-11,22-23,30-31H2,1-7H3;/q;-1/p+1/b33-24+,40-28-; |
InChiKey: | InChIKey=IXXSSOSIVQCHRQ-BHAIYBSRSA-O |
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