[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [3-(4-chlorophenyl)isoxazol-5-yl]methyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid [3-(4-chlorophenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [3-(4-chlorophenyl)isoxazol-5-yl]methyl ester Formula: C19H16ClNO5S MolecularWeight: 405.85204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClNO5S/c1-12-3-8-16(27(2,23)24)10-17(12)19(22)25-11-15-9-18(21-26-15)13-4-6-14(20)7-5-13/h3-10H,11H2,1-2H3