methyl 3-[4-[3-(4-fluorophenyl)-4-methylsulfonyl-phenyl]-1,3-oxazol-2-yl]propanoate

Systemtic Name: methyl 3-[4-[3-(4-fluorophenyl)-4-methylsulfonyl-phenyl]-1,3-oxazol-2-yl]propanoate Openeye Name: methyl 3-[4-[3-(4-fluorophenyl)-4-methylsulfonyl-phenyl]oxazol-2-yl]propanoate CAS Name: 3-[4-[3-(4-fluorophenyl)-4-methylsulfonylphenyl]-2-oxazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-fluorophenyl)-4-methylsulfonylphenyl]-1,3-oxazol-2-yl]propanoate Traditional Name: 3-[4-[3-(4-fluorophenyl)-4-mesyl-phenyl]oxazol-2-yl]propionic acid methyl ester Formula: C20H18FNO5S MolecularWeight: 403.424023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=NC(=CO1)C2=CC(=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)CCC1=NC(=CO1)C2=CC(=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H18FNO5S/c1-26-20(23)10-9-19-22-17(12-27-19)14-5-8-18(28(2,24)25)16(11-14)13-3-6-15(21)7-4-13/h3-8,11-12H,9-10H2,1-2H3