(4-phenanthren-4-ylphenanthren-3-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (4-phenanthren-4-ylphenanthren-3-yl) tris(fluoranyl)methanesulfonate Openeye Name: [4-(4-phenanthryl)-3-phenanthryl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-(4-phenanthrenyl)-3-phenanthrenyl] ester IUPAC Name: (4-phenanthren-4-ylphenanthren-3-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-(4-phenanthryl)-3-phenanthryl] ester Formula: C29H17F3O3S MolecularWeight: 502.50369

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC=C3)C4=C(C=CC5=C4C6=CC=CC=C6C=C5)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC=C3)C4=C(C=CC5=C4C6=CC=CC=C6C=C5)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C29H17F3O3S/c30-29(31,32)36(33,34)35-25-17-16-21-15-13-19-7-2-4-10-23(19)27(21)28(25)24-11-5-8-20-14-12-18-6-1-3-9-22(18)26(20)24/h1-17H