methyl 2-fluoranyl-6-[3-fluoranyl-4-[[(5-methoxy-5-oxidanylidene-pentanoyl)amino]methyl]phenyl]benzoate

Systemtic Name: methyl 2-fluoranyl-6-[3-fluoranyl-4-[[(5-methoxy-5-oxidanylidene-pentanoyl)amino]methyl]phenyl]benzoate Openeye Name: methyl 2-fluoro-6-[3-fluoro-4-[[(5-methoxy-5-oxo-pentanoyl)amino]methyl]phenyl]benzoate CAS Name: 2-fluoro-6-[3-fluoro-4-[[(5-methoxy-1,5-dioxopentyl)amino]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-6-[3-fluoro-4-[[(5-methoxy-5-oxopentanoyl)amino]methyl]phenyl]benzoate Traditional Name: 2-fluoro-6-[3-fluoro-4-[[(5-keto-5-methoxy-pentanoyl)amino]methyl]phenyl]benzoic acid methyl ester Formula: C21H21F2NO5 MolecularWeight: 405.391946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)NCC1=C(C=C(C=C1)C2=C(C(=CC=C2)F)C(=O)OC)F

Isomeric SMILES

COC(=O)CCCC(=O)NCC1=C(C=C(C=C1)C2=C(C(=CC=C2)F)C(=O)OC)F

InChI

InChI=1S/C21H21F2NO5/c1-28-19(26)8-4-7-18(25)24-12-14-10-9-13(11-17(14)23)15-5-3-6-16(22)20(15)21(27)29-2/h3,5-6,9-11H,4,7-8,12H2,1-2H3,(H,24,25)