[6-cyano-2,2-bis(fluoranylmethyl)chromen-4-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [6-cyano-2,2-bis(fluoranylmethyl)chromen-4-yl] tris(fluoranyl)methanesulfonate Openeye Name: [6-cyano-2,2-bis(fluoromethyl)chromen-4-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [6-cyano-2,2-bis(fluoromethyl)-1-benzopyran-4-yl] ester IUPAC Name: [6-cyano-2,2-bis(fluoromethyl)chromen-4-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [6-cyano-2,2-bis(fluoromethyl)chromen-4-yl] ester Formula: C13H8F5NO4S MolecularWeight: 369.263936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)C(=CC(O2)(CF)CF)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1C#N)C(=CC(O2)(CF)CF)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H8F5NO4S/c14-6-12(7-15)4-11(23-24(20,21)13(16,17)18)9-3-8(5-19)1-2-10(9)22-12/h1-4H,6-7H2