[4-[[2-(3-fluorophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] benzenesulfonate

Systemtic Name: [4-[[2-(3-fluorophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] benzenesulfonate Openeye Name: [4-[[2-(3-fluorophenyl)-5-oxo-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[[2-(3-fluorophenyl)-5-oxo-4-oxazolylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[2-(3-fluorophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-methoxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[[2-(3-fluorophenyl)-5-keto-2-oxazolin-4-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C23H16FNO6S MolecularWeight: 453.439643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)F)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)F)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H16FNO6S/c1-29-21-13-15(10-11-20(21)31-32(27,28)18-8-3-2-4-9-18)12-19-23(26)30-22(25-19)16-6-5-7-17(24)14-16/h2-14H,1H3