4-[bis(4-fluorophenyl)methoxy]-7-ethyl-1,3-dimethyl-8-piperidin-1-yl-5H-purine-2,6-dione

Systemtic Name: 4-[bis(4-fluorophenyl)methoxy]-7-ethyl-1,3-dimethyl-8-piperidin-1-yl-5H-purine-2,6-dione Openeye Name: 4-[bis(4-fluorophenyl)methoxy]-7-ethyl-1,3-dimethyl-8-(1-piperidyl)-5H-purine-2,6-dione CAS Name: 4-[bis(4-fluorophenyl)methoxy]-7-ethyl-1,3-dimethyl-8-(1-piperidinyl)-5H-purine-2,6-dione IUPAC Name: 4-[bis(4-fluorophenyl)methoxy]-7-ethyl-1,3-dimethyl-8-piperidin-1-yl-5H-purine-2,6-dione Traditional Name: 4-[bis(4-fluorophenyl)methoxy]-7-ethyl-1,3-dimethyl-8-piperidino-5H-purine-2,6-quinone Formula: C27H31F2N5O3 MolecularWeight: 511.563546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2C(=O)N(C(=O)N(C2(N=C1N3CCCCC3)OC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)C)C

Isomeric SMILES

CCN1C2C(=O)N(C(=O)N(C2(N=C1N3CCCCC3)OC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)C)C

InChI

InChI=1S/C27H31F2N5O3/c1-4-34-23-24(35)31(2)26(36)32(3)27(23,30-25(34)33-16-6-5-7-17-33)37-22(18-8-12-20(28)13-9-18)19-10-14-21(29)15-11-19/h8-15,22-23H,4-7,16-17H2,1-3H3