[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidenepentanoate

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidenepentanoate Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [2-(4-bromo-2-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl] ester Formula: C13H13BrFNO4 MolecularWeight: 346.149023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)OCC(=O)NC1=C(C=C(C=C1)Br)F

Isomeric SMILES

CC(=O)CCC(=O)OCC(=O)NC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C13H13BrFNO4/c1-8(17)2-5-13(19)20-7-12(18)16-11-4-3-9(14)6-10(11)15/h3-4,6H,2,5,7H2,1H3,(H,16,18)