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Substance Name: Benz(a)anthracene-3,4-diol, 1,2,3,4-tetrahydro-, diacetate, trans-
RN: 60968-11-8
InChIKey: CKWNHYNOPMGDJI-VXKWHMMOSA-N

Molecular Formula

  • C22-H20-O4

Molecular Weight

  • 348.396
 
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Names and Synonyms

  • Benz(a)anthracene-3,4-diol, 1,2,3,4-tetrahydro-, diacetate, trans-

Registry Numbers

CAS Registry Number

  • 60968-11-8

System Generated Number

  • 0060968118

Structure Descriptors

InChI

1S/C22H20O4/c1-13(23)25-21-10-9-18-19(22(21)26-14(2)24)8-7-17-11-15-5-3-4-6-16(15)12-20(17)18/h3-8,11-12,21-22H,9-10H2,1-2H3/t21-,22-/m0/s1

InChIKey

CKWNHYNOPMGDJI-VXKWHMMOSA-N

Smiles

c12c(ccc3cc4ccccc4cc13)[C@@H]([C@H](CC2)OC(C)=O)OC(C)=O