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

Systemtic Name: [7-(4-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 3-methoxybenzoate Openeye Name: [2-oxo-7-(p-tolyl)-1,3-benzoxathiol-5-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [2-keto-7-(p-tolyl)-1,3-benzoxathiol-5-yl] ester Formula: C22H16O5S MolecularWeight: 392.42444

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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(=CC=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H16O5S/c1-13-6-8-14(9-7-13)18-11-17(12-19-20(18)27-22(24)28-19)26-21(23)15-4-3-5-16(10-15)25-2/h3-12H,1-2H3