HIT ID: HIT218701028

Cas No:

分子式: C22H23FN2O5

分子量: 420.47

常用名: 1-{3-[di(2H3)methylamino]propyl}-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile; oxalic acid, Citalopram-d6 Oxalate

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 1-{3-[di(2H3)methylamino]propyl}-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile; oxalic acid

SMILES: OC(=O)C(O)=O.[2H]C([2H])([2H])N(CCCC1(OCc2cc(ccc12)C#N)c1ccc(F)cc1)C([2H])([2H])[2H]

InChI key: KTGRHKOEFSJQNS-TXHXQZCNSA-N