[5-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl 3-dodecanoyl-5-methyl-benzoate

Systemtic Name: [5-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl 3-dodecanoyl-5-methyl-benzoate Openeye Name: [5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl 3-dodecanoyl-5-methyl-benzoate CAS Name: 3-methyl-5-(1-oxododecyl)benzoic acid [5-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl 3-dodecanoyl-5-methylbenzoate Traditional Name: 3-lauroyl-5-methyl-benzoic acid [5-(5-fluoro-2,4-diketo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C29H39FN2O7 MolecularWeight: 546.627563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC(=CC(=C1)C)C(=O)OCC2C(CC(O2)N3C=C(C(=O)NC3=O)F)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC(=CC(=C1)C)C(=O)OCC2C(CC(O2)N3C=C(C(=O)NC3=O)F)O

InChI

InChI=1S/C29H39FN2O7/c1-3-4-5-6-7-8-9-10-11-12-23(33)20-13-19(2)14-21(15-20)28(36)38-18-25-24(34)16-26(39-25)32-17-22(30)27(35)31-29(32)37/h13-15,17,24-26,34H,3-12,16,18H2,1-2H3,(H,31,35,37)