5-[[3-[(4-ethanoyl-3-fluoranyl-phenoxy)methyl]phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[3-[(4-ethanoyl-3-fluoranyl-phenoxy)methyl]phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-[(4-acetyl-3-fluoro-phenoxy)methyl]anilino]-5-oxo-pentanoic acid CAS Name: 5-[3-[(4-acetyl-3-fluorophenoxy)methyl]anilino]-5-oxopentanoic acid IUPAC Name: 5-[3-[(4-acetyl-3-fluorophenoxy)methyl]anilino]-5-oxopentanoic acid Traditional Name: 5-[3-[(4-acetyl-3-fluoro-phenoxy)methyl]anilino]-5-keto-valeric acid Formula: C20H20FNO5 MolecularWeight: 373.374903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20FNO5/c1-13(23)17-9-8-16(11-18(17)21)27-12-14-4-2-5-15(10-14)22-19(24)6-3-7-20(25)26/h2,4-5,8-11H,3,6-7,12H2,1H3,(H,22,24)(H,25,26)