Analyte Name

Cisapride N-Oxide

CAS Number

86718-75-4

Molecular Formula

C23 H29 Cl F N3 O5

Molecular Weight

481.945

Accurate Mass

481.178

SMILES

CO[C@H]1CN(=O)(CCCOc2ccc(F)cc2)CC[C@H]1NC(=O)c3cc(Cl)c(N)cc3OC

InChI

InChI=1S/C23H29ClFN3O5/c1-31-21-13-19(26)18(24)12-17(21)23(29)27-20-8-10-28(30,14-22(20)32-2)9-3-11-33-16-6-4-15(25)5-7-16/h4-7,12-13,20,22H,3,8-11,14,26H2,1-2H3,(H,27,29)/t20-,22+,28?/m1/s1

IUPAC

4-amino-5-chloro-N-[(3S,4R)-1-[3-(4-fluorophenoxy)propyl]-3-methoxy-1-oxo-1?5-azinan-4-yl]-2-methoxybenzamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat