(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-methylsulfinylbenzoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-methylsulfinylbenzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 4-methylsulfinylbenzoate CAS Name: 4-methylsulfinylbenzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-methylsulfinylbenzoate Traditional Name: 4-methylsulfinylbenzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C14H15NO4S MolecularWeight: 293.3382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC=C(C=C2)S(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC=C(C=C2)S(=O)C

InChI

InChI=1S/C14H15NO4S/c1-9-13(10(2)19-15-9)8-18-14(16)11-4-6-12(7-5-11)20(3)17/h4-7H,8H2,1-3H3