[(2S)-5-oxidanylidene-1,2-bis(phenylmethyl)-2H-pyrrol-4-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [(2S)-5-oxidanylidene-1,2-bis(phenylmethyl)-2H-pyrrol-4-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(2S)-1,2-dibenzyl-5-oxo-2H-pyrrol-4-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(2S)-5-oxo-1,2-bis(phenylmethyl)-2H-pyrrol-4-yl] ester IUPAC Name: [(2S)-1,2-dibenzyl-5-oxo-2H-pyrrol-4-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(5S)-1,5-dibenzyl-2-keto-3-pyrrolin-3-yl] ester Formula: C19H16F3NO4S MolecularWeight: 411.39485

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C=C(C(=O)N2CC3=CC=CC=C3)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]2C=C(C(=O)N2CC3=CC=CC=C3)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C19H16F3NO4S/c20-19(21,22)28(25,26)27-17-12-16(11-14-7-3-1-4-8-14)23(18(17)24)13-15-9-5-2-6-10-15/h1-10,12,16H,11,13H2/t16-/m0/s1