2-(2-(2-CHLORO-3-(2-(1,1,3-TRIMETHYL-1H-BENZO[E]INDOL-2(3H)-YLIDENE)ETHYLIDENE)CYCLOPENT-1-ENYL)VINYL)-1,1,3-TRIMETHYL-1H-BENZO[E]INDOLIUM 4-METHYLBENZENESULFONATE

CAS No.
287182-34-7
CCD No.
CCD00356970
Formula
C39 H39 Cl N2 . 2 C7 H7 O3 S
MolWeight
913.595

Basic Information

Product Name: 2-(2-(2-CHLORO-3-(2-(1,1,3-TRIMETHYL-1H-BENZO[E]INDOL-2(3H)-YLIDENE)ETHYLIDENE)CYCLOPENT-1-ENYL)VINYL)-1,1,3-TRIMETHYL-1H-BENZO[E]INDOLIUM 4-METHYLBENZENESULFONATE
CAS: 287182-34-7
English Synonyms: 2-(2-(2-CHLORO-3-(2-(1,1,3-TRIMETHYL-1H-BENZO[E]INDOL-2(3H)-YLIDENE)ETHYLIDENE)CYCLOPENT-1-ENYL)VINYL)-1,1,3-TRIMETHYL-1H-BENZO[E]INDOLIUM 4-METHYLBENZENESULFONATE
MDL Number.: MFCD03093276
H bond acceptor: 2
H bond donor: 0
Smile: Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-].CC\1c2c3ccccc3ccc2[N+](/C1=C/C=C/4\CCC(=C4Cl)/C=C/C5=C(c6c7ccccc7ccc6[N+]5(C)C)C)(C)C
InChi: InChI=1S/C39H39ClN2.2C7H8O3S/c1-25-33(41(3,4)35-23-17-27-11-7-9-13-31(27)37(25)35)21-19-29-15-16-30(39(29)40)20-22-34-26(2)38-32-14-10-8-12-28(32)18-24-36(38)42(34,5)6;2*1-6-2-4-7(5-3-6)11(8,9)10/h7-14,17-25H,15-16H2,1-6H3;2*2-5H,1H3,(H,8,9,10)/q+2;;/p-2/b22-20+,29-19+,33-21+;;
InChiKey: InChIKey=HJCCHBXTOOFWNB-MCRLBXMXSA-L

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