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Substance Name: 2-((2R,6R)-6-((2S)-2-hydroxy-2-phenylethyl)-1-methyl-2-piperidyl)-1-phenylethanone
RN: 101686-76-4
InChIKey: PNZXTHVTWKIOAM-ODYJERINSA-N

Molecular Formula

  • C43-H41-Br4-N-O7-S

Molecular Weight

  • 1035.48
 
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Names and Synonyms

  • 2-((2R,6R)-6-((2S)-2-hydroxy-2-phenylethyl)-1-methyl-2-piperidyl)-1-phenylethanone

Registry Numbers

CAS Registry Number

  • 101686-76-4

System Generated Number

  • 0101686764

Structure Descriptors

InChI

1S/C22H27NO2.C21H14Br4O5S/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18;1-9-12(7-14(22)19(26)17(9)24)21(13-8-15(23)20(27)18(25)10(13)2)11-5-3-4-6-16(11)31(28,29)30-21/h2-7,9-12,19-21,24H,8,13-16H2,1H3;3-8,26-27H,1-2H3/t19-,20-,21+;/m1./s1

InChIKey

PNZXTHVTWKIOAM-ODYJERINSA-N

Smiles

S1(OC(c2c(c(c(c(c2)Br)O)Br)C)(c2c(c(c(c(c2)Br)O)Br)C)c2c1cccc2)(=O)=O.C(C[C@@H]1[N@@]([C@H](CCC1)C[C@@H](c1ccccc1)O)C)(c1ccccc1)=O