7-[3-[4-[bis(4-fluorophenyl)methoxy]piperidin-1-yl]propyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[3-[4-[bis(4-fluorophenyl)methoxy]piperidin-1-yl]propyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[3-[4-[bis(4-fluorophenyl)methoxy]-1-piperidyl]propyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[3-[4-[bis(4-fluorophenyl)methoxy]-1-piperidinyl]propyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[3-[4-[bis(4-fluorophenyl)methoxy]piperidin-1-yl]propyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[3-[4-[bis(4-fluorophenyl)methoxy]piperidino]propyl]-1,3-dimethyl-xanthine Formula: C28H31F2N5O3 MolecularWeight: 523.574246

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCN3CCC(CC3)OC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCN3CCC(CC3)OC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H31F2N5O3/c1-32-26-24(27(36)33(2)28(32)37)35(18-31-26)15-3-14-34-16-12-23(13-17-34)38-25(19-4-8-21(29)9-5-19)20-6-10-22(30)11-7-20/h4-11,18,23,25H,3,12-17H2,1-2H3