[(5Z)-4-methoxy-5-[(5-phenethyl-1H-pyrrol-2-yl)methylidene]pyrrol-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [(5Z)-4-methoxy-5-[(5-phenethyl-1H-pyrrol-2-yl)methylidene]pyrrol-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(5Z)-4-methoxy-5-[(5-phenethyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(5Z)-4-methoxy-5-[(5-phenethyl-1H-pyrrol-2-yl)methylidene]-2-pyrrolyl] ester IUPAC Name: [(5Z)-4-methoxy-5-[(5-phenethyl-1H-pyrrol-2-yl)methylidene]pyrrol-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(5Z)-4-methoxy-5-[(5-phenethyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] ester Formula: C19H17F3N2O4S MolecularWeight: 426.40949

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC1=CC2=CC=C(N2)CCC3=CC=CC=C3)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC\1=CC(=N/C1=C\C2=CC=C(N2)CCC3=CC=CC=C3)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C19H17F3N2O4S/c1-27-17-12-18(28-29(25,26)19(20,21)22)24-16(17)11-15-10-9-14(23-15)8-7-13-5-3-2-4-6-13/h2-6,9-12,23H,7-8H2,1H3/b16-11-