methyl 3-[3-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[3-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]propanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[3-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)propanoylamino]-3-phenyl-propanoate CAS Name: 3-[[3-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-(5-fluoro-2,4-dioxopyrimidin-1-yl)propanoylamino]-3-phenylpropanoate Traditional Name: 3-[3-(5-fluoro-2,4-diketo-pyrimidin-1-yl)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C17H18FN3O5 MolecularWeight: 363.340323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CCN2C=C(C(=O)NC2=O)F

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)CCN2C=C(C(=O)NC2=O)F

InChI

InChI=1S/C17H18FN3O5/c1-26-15(23)9-13(11-5-3-2-4-6-11)19-14(22)7-8-21-10-12(18)16(24)20-17(21)25/h2-6,10,13H,7-9H2,1H3,(H,19,22)(H,20,24,25)