[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 3-methylsulfonylbenzoate

Systemtic Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 3-methylsulfonylbenzoate Openeye Name: [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl ester Formula: C19H16FNO5S MolecularWeight: 389.397443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1COC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(ON=C1COC(=O)C2=CC(=CC=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H16FNO5S/c1-12-17(21-26-18(12)13-6-8-15(20)9-7-13)11-25-19(22)14-4-3-5-16(10-14)27(2,23)24/h3-10H,11H2,1-2H3