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Substance Name: Benzoic acid, 4-(dimethylamino)-, 1,2,3,4-tetrahydrobenz(a)anthracene-1,2-diyl ester, (1R-trans)-
RN: 86538-32-1
InChIKey: VZSHJHJMUDDLFN-CWTKIQHKSA-N

Molecular Weight

  • 558.675
 
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Names and Synonyms

  • Benzoic acid, 4-(dimethylamino)-, 1,2,3,4-tetrahydrobenz(a)anthracene-1,2-diyl ester, (1R-trans)-

Registry Numbers

CAS Registry Number

  • 86538-32-1

System Generated Number

  • 0086538321

Structure Descriptors

InChI

1S/C36H34N2O4/c1-37(2)29-16-11-24(12-17-29)35(39)41-32-20-15-23-9-10-28-21-26-7-5-6-8-27(26)22-31(28)33(23)34(32)42-36(40)25-13-18-30(19-14-25)38(3)4/h5-14,16-19,21-22,32,34H,15,20H2,1-4H3/t32-,34+/m1/s1

InChIKey

VZSHJHJMUDDLFN-CWTKIQHKSA-N

Smiles

c12c(ccc3cc4ccccc4cc13)CC[C@H]([C@@H]2OC(c1ccc(cc1)N(C)C)=O)OC(c1ccc(cc1)N(C)C)=O