2-(1,2-oxazol-5-ylmethylsulfanyl)benzoate

Systemtic Name: 2-(1,2-oxazol-5-ylmethylsulfanyl)benzoate Openeye Name: 2-(isoxazol-5-ylmethylsulfanyl)benzoate CAS Name: 2-(5-isoxazolylmethylthio)benzoate IUPAC Name: 2-(1,2-oxazol-5-ylmethylsulfanyl)benzoate Traditional Name: 2-(isoxazol-5-ylmethylthio)benzoate Formula: C11H8NO3S- MolecularWeight: 234.25112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])SCC2=CC=NO2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])SCC2=CC=NO2

InChI

InChI=1S/C11H9NO3S/c13-11(14)9-3-1-2-4-10(9)16-7-8-5-6-12-15-8/h1-6H,7H2,(H,13,14)/p-1