[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 3,5-dimethylisoxazole-4-carboxylate CAS Name: 3,5-dimethyl-4-isoxazolecarboxylic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate Traditional Name: 3,5-dimethylisoxazole-4-carboxylic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)OCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)OCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C15H15NO4S/c1-9-14(10(2)20-16-9)15(18)19-8-13(17)11-4-6-12(21-3)7-5-11/h4-7H,8H2,1-3H3