[7-(4-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] (2S)-2-(2-fluoranylphenoxy)propanoate

Systemtic Name: [7-(4-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] (2S)-2-(2-fluoranylphenoxy)propanoate Openeye Name: [2-oxo-7-(p-tolyl)-1,3-benzoxathiol-5-yl] (2S)-2-(2-fluorophenoxy)propanoate CAS Name: (2S)-2-(2-fluorophenoxy)propanoic acid [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] (2S)-2-(2-fluorophenoxy)propanoate Traditional Name: (2S)-2-(2-fluorophenoxy)propionic acid [2-keto-7-(p-tolyl)-1,3-benzoxathiol-5-yl] ester Formula: C23H17FO5S MolecularWeight: 424.441483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C(C)OC4=CC=CC=C4F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)[C@H](C)OC4=CC=CC=C4F

InChI

InChI=1S/C23H17FO5S/c1-13-7-9-15(10-8-13)17-11-16(12-20-21(17)29-23(26)30-20)28-22(25)14(2)27-19-6-4-3-5-18(19)24/h3-12,14H,1-2H3/t14-/m0/s1