[2-(phenanthren-9-ylmethyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(phenanthren-9-ylmethyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-(9-phenanthrylmethyl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(9-phenanthrenylmethyl)phenyl] ester IUPAC Name: [2-(phenanthren-9-ylmethyl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(9-phenanthrylmethyl)phenyl] ester Formula: C22H15F3O3S MolecularWeight: 416.41291

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)CC4=CC=CC=C4OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)CC4=CC=CC=C4OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C22H15F3O3S/c23-22(24,25)29(26,27)28-21-12-6-2-8-16(21)14-17-13-15-7-1-3-9-18(15)20-11-5-4-10-19(17)20/h1-13H,14H2