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Substance Name: EINECS 266-296-0
RN: 66276-83-3
InChIKey: QALNEMYTJKAHQP-UHFFFAOYSA-N

Molecular Formula

  • C77-H41-Cu-N13-O10

Molecular Weight

  • 1371.8
 
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Names and Synonyms

Results Name

  • EINECS 266-296-0

Synonym

  • EINECS 266-296-0

Systematic Names

  • ((2,2',2'',2''',2''''-(29H,31H-Phthalocyaninepentaylpentakis(methylene))pentakis(1H-isoindole-1,3(2H)-dionato))(2-)-N29,N30,N31,N32)copper
  • Copper, ((2,2',2'',2''',2''''-((29H,31H-phthalocyanine-C,C,C,C,C-pentayl-kappaN29,kappaN30,kappaN31,kappaN32)pentakis(methylene))pentakis(1H-isoindole-1,3(2H)-dionato))(2-))-
  • Copper, ((2,2',2'',2''',2''''-((29H,31H-phthalocyaninepentayl-kappaN29,kappaN30,kappaN31,kappaN32)pentakis(methylene))pentakis(1H-isoindole-1,3(2H)-dionato))(2-))-

Registry Numbers

CAS Registry Number

  • 66276-83-3

System Generated Number

  • 0066276833

Structure Descriptors

InChI

1S/C77H41N13O10.Cu/c91-68-44-13-1-2-14-45(44)69(92)86(68)32-37-24-26-42-55(28-37)63-79-60(42)78-62-54-23-11-12-39(34-88-72(95)48-17-5-6-18-49(48)73(88)96)59(54)67(85-62)84-61-43-27-25-38(33-87-70(93)46-15-3-4-16-47(46)71(87)94)29-56(43)64(80-61)82-66-58-31-41(36-90-76(99)52-21-9-10-22-53(52)77(90)100)40(30-57(58)65(81-63)83-66)35-89-74(97)50-19-7-8-20-51(50)75(89)98;/h1-31H,32-36H2;/q-2;+2

InChIKey

QALNEMYTJKAHQP-UHFFFAOYSA-N

Smiles

[Cu+2].c1(c2c(ccc1)c1nc2nc2c3ccc(CN4C(=O)c5c(cccc5)C4=O)cc3c(nc3c4cc(CN5C(c6c(C5=O)cccc6)=O)c(cc4c(n3)nc3c4c(c([n-]3)n1)ccc(CN1C(=O)c3c(cccc3)C1=O)c4)CN1C(c3c(C1=O)cccc3)=O)[n-]2)CN1C(c2ccccc2C1=O)=O