[(5E)-5-[(5-methyl-1H-pyrrol-2-yl)methylidene]-4-phenylmethoxy-pyrrol-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [(5E)-5-[(5-methyl-1H-pyrrol-2-yl)methylidene]-4-phenylmethoxy-pyrrol-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(5E)-4-benzyloxy-5-[(5-methyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(5E)-5-[(5-methyl-1H-pyrrol-2-yl)methylidene]-4-phenylmethoxy-2-pyrrolyl] ester IUPAC Name: [(5E)-5-[(5-methyl-1H-pyrrol-2-yl)methylidene]-4-phenylmethoxypyrrol-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(5E)-4-benzoxy-5-[(5-methyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] ester Formula: C18H15F3N2O4S MolecularWeight: 412.38291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1)C=C2C(=CC(=N2)OS(=O)(=O)C(F)(F)F)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(N1)/C=C/2\C(=CC(=N2)OS(=O)(=O)C(F)(F)F)OCC3=CC=CC=C3

InChI

InChI=1S/C18H15F3N2O4S/c1-12-7-8-14(22-12)9-15-16(26-11-13-5-3-2-4-6-13)10-17(23-15)27-28(24,25)18(19,20)21/h2-10,22H,11H2,1H3/b15-9+