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

Systemtic Name: [(5Z)-5-[(5-heptyl-1H-pyrrol-2-yl)methylidene]-4-phenylmethoxy-pyrrol-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(5Z)-4-benzyloxy-5-[(5-heptyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(5Z)-5-[(5-heptyl-1H-pyrrol-2-yl)methylidene]-4-phenylmethoxy-2-pyrrolyl] ester IUPAC Name: [(5Z)-5-[(5-heptyl-1H-pyrrol-2-yl)methylidene]-4-phenylmethoxypyrrol-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(5Z)-4-benzoxy-5-[(5-heptyl-1H-pyrrol-2-yl)methylene]pyrrol-2-yl] ester Formula: C24H27F3N2O4S MolecularWeight: 496.54239

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(N1)C=C2C(=CC(=N2)OS(=O)(=O)C(F)(F)F)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCC1=CC=C(N1)/C=C\2/C(=CC(=N2)OS(=O)(=O)C(F)(F)F)OCC3=CC=CC=C3

InChI

InChI=1S/C24H27F3N2O4S/c1-2-3-4-5-9-12-19-13-14-20(28-19)15-21-22(32-17-18-10-7-6-8-11-18)16-23(29-21)33-34(30,31)24(25,26)27/h6-8,10-11,13-16,28H,2-5,9,12,17H2,1H3/b21-15-