Analytenname

Hydroxy Rolapitant

CAS-Nummer

2238886-63-8

Molekularformel

C25H26F6N2O3

Molekulargewicht

516.48

Genaue Masse

516.1848

SMILES

C[C@@H](OC[C@]1(CC[C@]2(CN1)NC(=O)C[C@H]2O)c3ccccc3)c4cc(cc(c4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C25H26F6N2O3/c1-15(16-9-18(24(26,27)28)11-19(10-16)25(29,30)31)36-14-23(17-5-3-2-4-6-17)8-7-22(13-32-23)20(34)12-21(35)33-22/h2-6,9-11,15,20,32,34H,7-8,12-14H2,1H3,(H,33,35)/t15-,20-,22-,23-/m1/s1

IUPAC

(4R,5R,8S)-8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-4-hydroxy-8-phenyl-1,9-diazaspiro[4.5]decan-2-one

Herkunftsland

CANADA

Produktformat

Neat