2-[4-(4-methylsulfonylphenyl)-3-phenyl-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-methylsulfonylphenyl)-3-phenyl-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[4-(4-methylsulfonylphenyl)-3-phenyl-isoxazol-5-yl]acetic acid CAS Name: 2-[4-(4-methylsulfonylphenyl)-3-phenyl-5-isoxazolyl]acetic acid IUPAC Name: 2-[4-(4-methylsulfonylphenyl)-3-phenyl-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[4-(4-mesylphenyl)-3-phenyl-isoxazol-5-yl]acetic acid Formula: C18H15NO5S MolecularWeight: 357.3804

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)CC(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C18H15NO5S/c1-25(22,23)14-9-7-12(8-10-14)17-15(11-16(20)21)24-19-18(17)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,20,21)