Molecular structure of (E,E)-1-Butyl-2-[3-(1-butylbenz[cd]indol-2(1H)-ylidene)-1-propenyl]benz[cd]indolium tetrafluoroborate(1-) (CAS NO.143185-79-9) is:
Product Name: (E,E)-1-Butyl-2-[3-(1-butylbenz[cd]indol-2(1H)-ylidene)-1-propenyl]benz[cd]indolium tetrafluoroborate(1-)
CAS Registry Number: 143185-79-9
Molecular Formula: C33H33N2.BF4
Molecular Weight: 544.44
SMILES: [B-](F)(F)(F)F.CCCCn1c2cccc3c2c(c1=CC=CC4=[N+](c5cccc6c5c4ccc6)CCCC)ccc3
InChI: InChI=1/C33H33N2.BF4/c1-3-5-22-34-28(26-16-7-12-24-14-9-20-30(34)32(24)26)18-11-19-29-27-17-8-13-25-15-10-21-31(33(25)27)35(29)23-6-4-2;2-1(3,4)5/h7-21H,3-6,22-23H2,1-2H3;/q+1;-1
InChIKey: RLDUSRNJMKEHTI-UHFFFAOYAB
Std. InChI: InChI=1S/C33H33N2.BF4/c1-3-5-22-34-28(26-16-7-12-24-14-9-20-30(34)32(24)26)18-11-19-29-27-17-8-13-25-15-10-21-31(33(25)27)35(29)23-6-4-2;2-1(3,4)5/h7-21H,3-6,22-23H2,1-2H3;/q+1;-1
Std. InChIKey: RLDUSRNJMKEHTI-UHFFFAOYSA-N
(E,E)-1-Butyl-2-[3-(1-butylbenz[cd]indol-2(1H)-ylidene)-1-propenyl]benz[cd]indolium tetrafluoroborate(1-) , its cas register number is 143185-79-9. It also can be called 1-Butyl-2-((E)-3-[1-Butylbenzo[Cd]Indol-2(1h)-Ylidene]-1-Propenyl)Benzo[Cd]Indolium Tetrafluoroborate .
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