4’-Hydroxy Trazodone-d6 Benzyl Ether

Analyte Name

4'-Hydroxy Trazodone-d6 Benzyl Ether

CAS Number

1794752-37-6

Molecular Formula

C26 2H6 H22 Cl N5 O2

Molecular Weight

484.023

Accurate Mass

483.231

SMILES

[2H]C([2H])(N1CCN(CC1)c2ccc(OCc3ccccc3)c(Cl)c2)C([2H])([2H])C([2H])([2H])N4N=C5C=CC=CN5C4=O

InChI

InChI=1S/C26H28ClN5O2/c27-23-19-22(10-11-24(23)34-20-21-7-2-1-3-8-21)30-17-15-29(16-18-30)12-6-14-32-26(33)31-13-5-4-9-25(31)28-32/h1-5,7-11,13,19H,6,12,14-18,20H2/i6D2,12D2,14D2

IUPAC

2-[3-[4-(3-chloro-4-phenylmethoxyphenyl)piperazin-1-yl]-1,1,2,2,3,3-hexadeuteriopropyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one

Unlabelled CAS Number

1797905-74-8

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat