[2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzoxazol-6-yl] ethanoate

Systemtic Name: [2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzoxazol-6-yl] ethanoate Openeye Name: [2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazol-6-yl] acetate CAS Name: acetic acid [2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazol-6-yl] ester IUPAC Name: [2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazol-6-yl] acetate Traditional Name: acetic acid [2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazol-6-yl] ester Formula: C13H11F2NO3S MolecularWeight: 299.293146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)N=C(O2)SCCC=C(F)F

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)N=C(O2)SCCC=C(F)F

InChI

InChI=1S/C13H11F2NO3S/c1-8(17)18-9-4-5-10-11(7-9)19-13(16-10)20-6-2-3-12(14)15/h3-5,7H,2,6H2,1H3