methyl 2-ethyl-3-(3-methyl-1,2-oxazol-5-yl)-4-methylsulfanyl-benzoate

Systemtic Name: methyl 2-ethyl-3-(3-methyl-1,2-oxazol-5-yl)-4-methylsulfanyl-benzoate Openeye Name: methyl 2-ethyl-3-(3-methylisoxazol-5-yl)-4-methylsulfanyl-benzoate CAS Name: 2-ethyl-3-(3-methyl-5-isoxazolyl)-4-(methylthio)benzoic acid methyl ester IUPAC Name: methyl 2-ethyl-3-(3-methyl-1,2-oxazol-5-yl)-4-methylsulfanylbenzoate Traditional Name: 2-ethyl-3-(3-methylisoxazol-5-yl)-4-(methylthio)benzoic acid methyl ester Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1C2=CC(=NO2)C)SC)C(=O)OC

Isomeric SMILES

CCC1=C(C=CC(=C1C2=CC(=NO2)C)SC)C(=O)OC

InChI

InChI=1S/C15H17NO3S/c1-5-10-11(15(17)18-3)6-7-13(20-4)14(10)12-8-9(2)16-19-12/h6-8H,5H2,1-4H3