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

Systemtic Name: [2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzoxazol-4-yl] propanoate Openeye Name: [2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazol-4-yl] propanoate CAS Name: propanoic acid [2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazol-4-yl] ester IUPAC Name: [2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazol-4-yl] propanoate Traditional Name: propionic acid [2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazol-4-yl] ester Formula: C14H13F2NO3S MolecularWeight: 313.319726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC2=C1N=C(O2)SCCC=C(F)F

Isomeric SMILES

CCC(=O)OC1=CC=CC2=C1N=C(O2)SCCC=C(F)F

InChI

InChI=1S/C14H13F2NO3S/c1-2-12(18)19-9-5-3-6-10-13(9)17-14(20-10)21-8-4-7-11(15)16/h3,5-7H,2,4,8H2,1H3