O6-[[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl] O1-(phenylmethyl) hexanedioate

Systemtic Name: O6-[[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl] O1-(phenylmethyl) hexanedioate Openeye Name: O1-benzyl O6-[(5-fluoro-2,4-dioxo-pyrimidin-1-yl)methyl] hexanedioate CAS Name: hexanedioic acid O6-[(5-fluoro-2,4-dioxo-1-pyrimidinyl)methyl] ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 6-O-[(5-fluoro-2,4-dioxopyrimidin-1-yl)methyl] hexanedioate Traditional Name: adipic acid O1-benzyl ester O6-[(5-fluoro-2,4-diketo-pyrimidin-1-yl)methyl] ester Formula: C18H19FN2O6 MolecularWeight: 378.351663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OCN2C=C(C(=O)NC2=O)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCC(=O)OCN2C=C(C(=O)NC2=O)F

InChI

InChI=1S/C18H19FN2O6/c19-14-10-21(18(25)20-17(14)24)12-27-16(23)9-5-4-8-15(22)26-11-13-6-2-1-3-7-13/h1-3,6-7,10H,4-5,8-9,11-12H2,(H,20,24,25)