9-[(4-fluorophenyl)methyl]-1,3-dimethyl-8-oxidanyl-2H-purino[7,8-a]pyrimidine-4,6-dione

Systemtic Name: 9-[(4-fluorophenyl)methyl]-1,3-dimethyl-8-oxidanyl-2H-purino[7,8-a]pyrimidine-4,6-dione Openeye Name: 9-[(4-fluorophenyl)methyl]-8-hydroxy-1,3-dimethyl-2H-purino[7,8-a]pyrimidine-4,6-dione CAS Name: 9-[(4-fluorophenyl)methyl]-8-hydroxy-1,3-dimethyl-2H-purino[7,8-a]pyrimidine-4,6-dione IUPAC Name: 9-[(4-fluorophenyl)methyl]-8-hydroxy-1,3-dimethyl-2H-purino[7,8-a]pyrimidine-4,6-dione Traditional Name: 9-(4-fluorobenzyl)-8-hydroxy-1,3-dimethyl-2H-purino[7,8-a]pyrimidine-4,6-quinone Formula: C17H16FN5O3 MolecularWeight: 357.339043

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C(=O)C2=C1N=C3N2C(=O)C=C(N3CC4=CC=C(C=C4)F)O)C

Isomeric SMILES

CN1CN(C(=O)C2=C1N=C3N2C(=O)C=C(N3CC4=CC=C(C=C4)F)O)C

InChI

InChI=1S/C17H16FN5O3/c1-20-9-21(2)16(26)14-15(20)19-17-22(12(24)7-13(25)23(14)17)8-10-3-5-11(18)6-4-10/h3-7,24H,8-9H2,1-2H3