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

Systemtic Name: ethyl 3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfanyl-benzoate Openeye Name: ethyl 3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-methylsulfanyl-benzoate CAS Name: 3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylthio)benzoic acid ethyl ester IUPAC Name: ethyl 3-(4,5-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfanylbenzoate Traditional Name: 3-(2-isoxazolin-3-yl)-2-methyl-4-(methylthio)benzoic acid ethyl ester Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1)SC)C2=NOCC2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1)SC)C2=NOCC2)C

InChI

InChI=1S/C14H17NO3S/c1-4-17-14(16)10-5-6-12(19-3)13(9(10)2)11-7-8-18-15-11/h5-6H,4,7-8H2,1-3H3