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

Systemtic Name: [7-(4-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 2,2-diphenylethanoate Openeye Name: [2-oxo-7-(p-tolyl)-1,3-benzoxathiol-5-yl] 2,2-diphenylacetate CAS Name: 2,2-diphenylacetic acid [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 2,2-diphenylacetate Traditional Name: 2,2-diphenylacetic acid [2-keto-7-(p-tolyl)-1,3-benzoxathiol-5-yl] ester Formula: C28H20O4S MolecularWeight: 452.521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H20O4S/c1-18-12-14-19(15-13-18)23-16-22(17-24-26(23)32-28(30)33-24)31-27(29)25(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-17,25H,1H3