Aripiprazole-d8

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CATAPS1089115069
CAS1089115-06-9
Structure
SynonymsAripiprazole-(piperazin-D8)
IUPAC Name7-[4-[2,2,3,3,5,5,6,6-octadeuterio-4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
Molecular Weight456.43
Molecular FormulaC232H8H19Cl2N3O2
Canonical SMILES[2H]C1([2H])N(CCCCOc2ccc3CCC(=O)Nc3c2)C([2H])([2H])C([2H])([2H])N(c4cccc(Cl)c4Cl)C1([2H])[2H]
InChIInChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)/i11D2,12D2,13D2,14D2
Accurate Mass455.1982
FormatNeat
Product TypeStable Isotope Labelled
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