2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzoxazole-5-carboxylic acid

Systemtic Name: 2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzoxazole-5-carboxylic acid Openeye Name: 2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazole-5-carboxylic acid CAS Name: 2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazole-5-carboxylic acid IUPAC Name: 2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzoxazole-5-carboxylic acid Traditional Name: 2-(4,4-difluorobut-3-enylthio)-1,3-benzoxazole-5-carboxylic acid Formula: C12H9F2NO3S MolecularWeight: 285.266566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)N=C(O2)SCCC=C(F)F

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)N=C(O2)SCCC=C(F)F

InChI

InChI=1S/C12H9F2NO3S/c13-10(14)2-1-5-19-12-15-8-6-7(11(16)17)3-4-9(8)18-12/h2-4,6H,1,5H2,(H,16,17)