Nazwa analitu

Serdexmethylphenidate Methyl Ester Impurity

Wzór cząsteczkowy

C26H32N3O8.Cl

Masa cząsteczkowa

550

Dokładna masa

549.18

SMILES

O=C(N[C@H](C(OC)=O)CO)C1=C[N+](COC(N2CCCC[C@@H]2[C@H](C(OC)=O)C3=CC=CC=C3)=O)=CC=C1.[Cl-]

InChI

InChI=1S/C26H31N3O8.ClH/c1-35-24(32)20(16-30)27-23(31)19-11-8-13-28(15-19)17-37-26(34)29-14-7-6-12-21(29)22(25(33)36-2)18-9-4-3-5-10-18;/h3-5,8-11,13,15,20-22,30H,6-7,12,14,16-17H2,1-2H3;1H/t20-,21+,22+;/m0./s1

IUPAC

[3-[[(1S)-1-(hydroxymethyl)-2-methoxy-2-oxo-ethyl]carbamoyl]pyridin-1-ium-1-yl]methyl (2R)-2-[(1R)-2-methoxy-2-oxo-1-phenyl-ethyl]piperidine-1-carboxylate chloride

Kraj pochodzenia

CANADA

Postać produktu

Neat