(2,9,9-trimethoxy-7-methyl-10-oxidanyl-8,10-dihydro-7H-phenanthridin-6-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2,9,9-trimethoxy-7-methyl-10-oxidanyl-8,10-dihydro-7H-phenanthridin-6-yl) tris(fluoranyl)methanesulfonate Openeye Name: (10-hydroxy-2,9,9-trimethoxy-7-methyl-8,10-dihydro-7H-phenanthridin-6-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (10-hydroxy-2,9,9-trimethoxy-7-methyl-8,10-dihydro-7H-phenanthridin-6-yl) ester IUPAC Name: (10-hydroxy-2,9,9-trimethoxy-7-methyl-8,10-dihydro-7H-phenanthridin-6-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (10-hydroxy-2,9,9-trimethoxy-7-methyl-8,10-dihydro-7H-phenanthridin-6-yl) ester Formula: C18H20F3NO7S MolecularWeight: 451.41411

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C2=C3C=C(C=CC3=NC(=C12)OS(=O)(=O)C(F)(F)F)OC)O)(OC)OC

Isomeric SMILES

CC1CC(C(C2=C3C=C(C=CC3=NC(=C12)OS(=O)(=O)C(F)(F)F)OC)O)(OC)OC

InChI

InChI=1S/C18H20F3NO7S/c1-9-8-17(27-3,28-4)15(23)14-11-7-10(26-2)5-6-12(11)22-16(13(9)14)29-30(24,25)18(19,20)21/h5-7,9,15,23H,8H2,1-4H3