4-[[3-[(4-ethanoyl-3-fluoranyl-phenoxy)methyl]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[(4-ethanoyl-3-fluoranyl-phenoxy)methyl]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[(4-acetyl-3-fluoro-phenoxy)methyl]anilino]-4-oxo-butanoic acid CAS Name: 4-[3-[(4-acetyl-3-fluorophenoxy)methyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[3-[(4-acetyl-3-fluorophenoxy)methyl]anilino]-4-oxobutanoic acid Traditional Name: 4-[3-[(4-acetyl-3-fluoro-phenoxy)methyl]anilino]-4-keto-butyric acid Formula: C19H18FNO5 MolecularWeight: 359.348323

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCC2=CC(=CC=C2)NC(=O)CCC(=O)O)F

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCC2=CC(=CC=C2)NC(=O)CCC(=O)O)F

InChI

InChI=1S/C19H18FNO5/c1-12(22)16-6-5-15(10-17(16)20)26-11-13-3-2-4-14(9-13)21-18(23)7-8-19(24)25/h2-6,9-10H,7-8,11H2,1H3,(H,21,23)(H,24,25)