Analyte Name

Trandolapril diketopiperazine

CAS Number

149881-40-3

Molecular Formula

C24 H32 N2 O4

Molecular Weight

412.52

Accurate Mass

412.2362

Flash Point

5

SMILES

CCOC(=O)[C@H](CCc1ccccc1)N2[C@@H](C)C(=O)N3[C@H]4CCCC[C@@H]4C[C@H]3C2=O

InChI

InChI=1S/C24H32N2O4/c1-3-30-24(29)20(14-13-17-9-5-4-6-10-17)25-16(2)22(27)26-19-12-8-7-11-18(19)15-21(26)23(25)28/h4-6,9-10,16,18-21H,3,7-8,11-15H2,1-2H3/t16-,18+,19-,20-,21-/m0/s1

IUPAC

ethyl (2S)-2-[(3S,5aS,9aR,10aS)-3-methyl-1,4-dioxo-5a,6,7,8,9,9a,10,10a-octahydro-3H-pyrazino[1,2-a]indol-2-yl]-4-phenylbutanoate

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

FRANCE

Tariff Code

29339980

Product Format

Neat

API Family

Trandolapril

Analytical Method

Monograph only