Analyte Name

Benzyl 4-(4-cyano-2-methoxyphenyl)-8-methyl-2-(methyl-13C)-5-oxo-1,4,5,6-tetrahydro-1,6-naphthyridine-3-carboxylate-2,3-13C2

Molecular Formula

13C4 C22 H23 N3 O4

Molecular Weight

445.449

Accurate Mass

445.182

SMILES

[13CH3][13C]1=[13C](C(C2=C(N1)C(=CNC2=O)C)c3ccc(cc3OC)C#N)[13C](=O)OCc4ccccc4

InChI

InChI=1S/C26H23N3O4/c1-15-13-28-25(30)23-22(19-10-9-18(12-27)11-20(19)32-3)21(16(2)29-24(15)23)26(31)33-14-17-7-5-4-6-8-17/h4-11,13,22,29H,14H2,1-3H3,(H,28,30)/i2+1,16+1,21+1,26+1

IUPAC

benzyl 4-(4-cyano-2-methoxyphenyl)-8-methyl-2-(113C)methyl-5-oxo-4,6-dihydro-1H-1,6-naphthyridine-3-carboxylate

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat