(1-naphthalen-1-ylisoquinolin-3-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (1-naphthalen-1-ylisoquinolin-3-yl) tris(fluoranyl)methanesulfonate Openeye Name: [1-(1-naphthyl)-3-isoquinolyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [1-(1-naphthalenyl)-3-isoquinolinyl] ester IUPAC Name: (1-naphthalen-1-ylisoquinolin-3-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [1-(1-naphthyl)-3-isoquinolyl] ester Formula: C20H12F3NO3S MolecularWeight: 403.37439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC(=CC4=CC=CC=C43)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC(=CC4=CC=CC=C43)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C20H12F3NO3S/c21-20(22,23)28(25,26)27-18-12-14-7-2-4-10-16(14)19(24-18)17-11-5-8-13-6-1-3-9-15(13)17/h1-12H