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

Systemtic Name: [(5Z)-4-ethoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrol-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(5Z)-4-ethoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(5Z)-4-ethoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylidene]-2-pyrrolyl] ester IUPAC Name: [(5Z)-4-ethoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrol-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(5Z)-4-ethoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] ester Formula: C23H33F3N2O4S MolecularWeight: 490.57933

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(N1)C=C2C(=CC(=N2)OS(=O)(=O)C(F)(F)F)OCC

Isomeric SMILES

CCCCCCCCCCCC1=CC=C(N1)/C=C\2/C(=CC(=N2)OS(=O)(=O)C(F)(F)F)OCC

InChI

InChI=1S/C23H33F3N2O4S/c1-3-5-6-7-8-9-10-11-12-13-18-14-15-19(27-18)16-20-21(31-4-2)17-22(28-20)32-33(29,30)23(24,25)26/h14-17,27H,3-13H2,1-2H3/b20-16-