(2-acetamido-1,4-dimethoxy-acridin-9-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2-acetamido-1,4-dimethoxy-acridin-9-yl) tris(fluoranyl)methanesulfonate Openeye Name: (2-acetamido-1,4-dimethoxy-acridin-9-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2-acetamido-1,4-dimethoxy-9-acridinyl) ester IUPAC Name: (2-acetamido-1,4-dimethoxyacridin-9-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2-acetamido-1,4-dimethoxy-acridin-9-yl) ester Formula: C18H15F3N2O6S MolecularWeight: 444.38171

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(C3=CC=CC=C3N=C2C(=C1)OC)OS(=O)(=O)C(F)(F)F)OC

Isomeric SMILES

CC(=O)NC1=C(C2=C(C3=CC=CC=C3N=C2C(=C1)OC)OS(=O)(=O)C(F)(F)F)OC

InChI

InChI=1S/C18H15F3N2O6S/c1-9(24)22-12-8-13(27-2)15-14(17(12)28-3)16(29-30(25,26)18(19,20)21)10-6-4-5-7-11(10)23-15/h4-8H,1-3H3,(H,22,24)