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

Systemtic Name: [(5Z)-4-methoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrol-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(5Z)-4-methoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(5Z)-4-methoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylidene]-2-pyrrolyl] ester IUPAC Name: [(5Z)-4-methoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrol-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(5Z)-4-methoxy-5-[(5-undecyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] ester Formula: C22H31F3N2O4S MolecularWeight: 476.55275

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H31F3N2O4S/c1-3-4-5-6-7-8-9-10-11-12-17-13-14-18(26-17)15-19-20(30-2)16-21(27-19)31-32(28,29)22(23,24)25/h13-16,26H,3-12H2,1-2H3/b19-15-