(3-methanoyl-4-propan-2-yl-quinolin-2-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (3-methanoyl-4-propan-2-yl-quinolin-2-yl) tris(fluoranyl)methanesulfonate Openeye Name: (3-formyl-4-isopropyl-2-quinolyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (3-formyl-4-propan-2-yl-2-quinolinyl) ester IUPAC Name: (3-formyl-4-propan-2-ylquinolin-2-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (3-formyl-4-isopropyl-2-quinolyl) ester Formula: C14H12F3NO4S MolecularWeight: 347.30959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NC2=CC=CC=C21)OS(=O)(=O)C(F)(F)F)C=O

Isomeric SMILES

CC(C)C1=C(C(=NC2=CC=CC=C21)OS(=O)(=O)C(F)(F)F)C=O

InChI

InChI=1S/C14H12F3NO4S/c1-8(2)12-9-5-3-4-6-11(9)18-13(10(12)7-19)22-23(20,21)14(15,16)17/h3-8H,1-2H3