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Substance Name: Anthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone,2,9-bis(2,5-bis(1,1-dimethylethyl)phenyl)-
RN: 83054-80-2
InChIKey: BIYPCKKQAHLMHG-UHFFFAOYSA-N

Molecular Formula

  • C52-H50-N2-O4

Molecular Weight

  • 766.977
 
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Names and Synonyms

  • Anthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone,2,9-bis(2,5-bis(1,1-dimethylethyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 83054-80-2

System Generated Number

  • 0083054802

Structure Descriptors

InChI

1S/C52H50N2O4/c1-49(2,3)27-13-23-37(51(7,8)9)39(25-27)53-45(55)33-19-15-29-31-17-21-35-44-36(22-18-32(42(31)44)30-16-20-34(46(53)56)43(33)41(29)30)48(58)54(47(35)57)40-26-28(50(4,5)6)14-24-38(40)52(10,11)12/h13-26H,1-12H3

InChIKey

BIYPCKKQAHLMHG-UHFFFAOYSA-N

Smiles

c1c2C(=O)N(c3c(C(C)(C)C)ccc(c3)C(C)(C)C)C(=O)c3c2c2c(c1)c1ccc4C(N(C(c5ccc(c1c45)c2cc3)=O)c1c(ccc(c1)C(C)(C)C)C(C)(C)C)=O