Analyte Name

Desfluoro Cisapride

CAS Number

105249-06-7

Molecular Formula

C24 H31 Cl N2 O4

Molecular Weight

446.967

Accurate Mass

446.197

SMILES

CO[C@H]1CC(CCCOc2ccccc2)CC[C@H]1NC(=O)c3cc(Cl)c(N)cc3OC

InChI

InChI=1S/C24H31ClN2O4/c1-29-22-15-20(26)19(25)14-18(22)24(28)27-21-11-10-16(13-23(21)30-2)7-6-12-31-17-8-4-3-5-9-17/h3-5,8-9,14-16,21,23H,6-7,10-13,26H2,1-2H3,(H,27,28)/t16?,21-,23+/m1/s1

IUPAC

4-amino-5-chloro-2-methoxy-N-[(1R,2S)-2-methoxy-4-(3-phenoxypropyl)cyclohexyl]benzamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat