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Substance Name: Estra-1,3,5(10)-trien-17-amine, 3-methoxy-N-((3-(trifluoromethyl)phenyl)methyl)-, (17beta)-
RN: 112648-26-7
InChIKey: KVEJLPFDAKDLEH-JMTTVTNBSA-N

Molecular Formula

  • C27-H32-F3-N-O

Molecular Weight

  • 443.55
 
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Names and Synonyms

Synonym

  • 3-Methoxy-N-((3-(trifluoromethyl)phenyl)methyl)estra-1,3,5(10)-trien-17-amine (17beta)-

Systematic Name

  • Estra-1,3,5(10)-trien-17-amine, 3-methoxy-N-((3-(trifluoromethyl)phenyl)methyl)-, (17beta)-

Registry Numbers

CAS Registry Number

  • 112648-26-7

System Generated Number

  • 0112648267

Structure Descriptors

InChI

1S/C27H32F3NO/c1-26-13-12-22-21-9-7-20(32-2)15-18(21)6-8-23(22)24(26)10-11-25(26)31-16-17-4-3-5-19(14-17)27(28,29)30/h3-5,7,9,14-15,22-25,31H,6,8,10-13,16H2,1-2H3/t22-,23-,24+,25+,26+/m1/s1

InChIKey

KVEJLPFDAKDLEH-JMTTVTNBSA-N

Smiles

c1(ccc2[C@H]3CC[C@@]4([C@H](CC[C@@H]4[C@@H]3CCc2c1)NCc1cc(ccc1)C(F)(F)F)C)OC