1,3-benzodioxol-5-yl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoate Openeye Name: 1,3-benzodioxol-5-yl 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]acetic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetic acid 1,3-benzodioxol-5-yl ester Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H15NO5S/c1-9-12(10(2)21-16-9)6-22-7-15(17)20-11-3-4-13-14(5-11)19-8-18-13/h3-5H,6-8H2,1-2H3