[7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl] tris(fluoranyl)methanesulfonate Openeye Name: [7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl] ester IUPAC Name: [7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [7-propyl-3-(trifluoromethyl)indoxazen-6-yl] ester Formula: C12H9F6NO4S MolecularWeight: 377.259579

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1ON=C2C(F)(F)F)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCC1=C(C=CC2=C1ON=C2C(F)(F)F)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C12H9F6NO4S/c1-2-3-6-8(23-24(20,21)12(16,17)18)5-4-7-9(6)22-19-10(7)11(13,14)15/h4-5H,2-3H2,1H3