methyl 3-[5-(2-azanyl-2-oxidanylidene-ethoxy)-4-ethynyl-2-fluoranyl-phenyl]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[5-(2-azanyl-2-oxidanylidene-ethoxy)-4-ethynyl-2-fluoranyl-phenyl]-3-oxidanylidene-propanoate Openeye Name: methyl 3-[5-(2-amino-2-oxo-ethoxy)-4-ethynyl-2-fluoro-phenyl]-3-oxo-propanoate CAS Name: 3-[5-(2-amino-2-oxoethoxy)-4-ethynyl-2-fluorophenyl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[5-(2-amino-2-oxoethoxy)-4-ethynyl-2-fluorophenyl]-3-oxopropanoate Traditional Name: 3-[5-(2-amino-2-keto-ethoxy)-4-ethynyl-2-fluoro-phenyl]-3-keto-propionic acid methyl ester Formula: C14H12FNO5 MolecularWeight: 293.247183

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C1=C(C=C(C(=C1)OCC(=O)N)C#C)F

Isomeric SMILES

COC(=O)CC(=O)C1=C(C=C(C(=C1)OCC(=O)N)C#C)F

InChI

InChI=1S/C14H12FNO5/c1-3-8-4-10(15)9(11(17)6-14(19)20-2)5-12(8)21-7-13(16)18/h1,4-5H,6-7H2,2H3,(H2,16,18)