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

Systemtic Name: [7-(4-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 4-methylbenzoate Openeye Name: [2-oxo-7-(p-tolyl)-1,3-benzoxathiol-5-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-keto-7-(p-tolyl)-1,3-benzoxathiol-5-yl] ester Formula: C22H16O4S MolecularWeight: 376.42504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16O4S/c1-13-3-7-15(8-4-13)18-11-17(12-19-20(18)26-22(24)27-19)25-21(23)16-9-5-14(2)6-10-16/h3-12H,1-2H3