(4R,12aS)-9-Bromo-3,4,12,12a-tetrahydro-4-methyl-7-(phenylmethoxy)-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-d2-6,8-dione

Analyte Name

(4R,12aS)-9-Bromo-3,4,12,12a-tetrahydro-4-methyl-7-(phenylmethoxy)-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-d2-6,8-dione

Molecular Formula

C19 D2 H17 Br N2 O4

Molecular Weight

421.281

Accurate Mass

420.065

SMILES

[2H]C1([2H])C[C@@H](C)N2[C@H](CN3C=C(Br)C(=O)C(=C3C2=O)OCc4ccccc4)O1

InChI

InChI=1S/C19H19BrN2O4/c1-12-7-8-25-15-10-21-9-14(20)17(23)18(16(21)19(24)22(12)15)26-11-13-5-3-2-4-6-13/h2-6,9,12,15H,7-8,10-11H2,1H3/t12-,15+/m1/s1/i8D2

IUPAC

(3S,7R)-13-bromo-5,5-dideuterio-7-methyl-11-phenylmethoxy-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-9,12-dione

Unlabelled CAS Number

1206102-10-4

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat