methyl 3-[4-(4-fluorophenyl)carbonylphenoxy]sulfonylbenzoate

Systemtic Name: methyl 3-[4-(4-fluorophenyl)carbonylphenoxy]sulfonylbenzoate Openeye Name: methyl 3-[4-(4-fluorobenzoyl)phenoxy]sulfonylbenzoate CAS Name: 3-[4-[(4-fluorophenyl)-oxomethyl]phenoxy]sulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-[4-(4-fluorobenzoyl)phenoxy]sulfonylbenzoate Traditional Name: 3-[4-(4-fluorobenzoyl)phenoxy]sulfonylbenzoic acid methyl ester Formula: C21H15FO6S MolecularWeight: 414.403603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H15FO6S/c1-27-21(24)16-3-2-4-19(13-16)29(25,26)28-18-11-7-15(8-12-18)20(23)14-5-9-17(22)10-6-14/h2-13H,1H3