(2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]benzoic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]benzoic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C20H20FNO5S MolecularWeight: 405.439903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)OC(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C20H20FNO5S/c1-13(2)27-19(24)11-26-20(25)16-5-3-4-6-17(16)28-12-18(23)22-15-9-7-14(21)8-10-15/h3-10,13H,11-12H2,1-2H3,(H,22,23)