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

Systemtic Name: [7-(4-methoxyphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] 3-methoxybenzoate Openeye Name: [7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [2-keto-7-(4-methoxyphenyl)-1,3-benzoxathiol-5-yl] ester Formula: C22H16O6S MolecularWeight: 408.42384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C22H16O6S/c1-25-15-8-6-13(7-9-15)18-11-17(12-19-20(18)28-22(24)29-19)27-21(23)14-4-3-5-16(10-14)26-2/h3-12H,1-2H3