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

Systemtic Name: [7-(3-methoxyphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] benzoate Openeye Name: [7-(3-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] benzoate CAS Name: benzoic acid [7-(3-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(3-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl] benzoate Traditional Name: benzoic acid [2-keto-7-(3-methoxyphenyl)-1,3-benzoxathiol-5-yl] ester Formula: C21H14O5S MolecularWeight: 378.39786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14O5S/c1-24-15-9-5-8-14(10-15)17-11-16(12-18-19(17)26-21(23)27-18)25-20(22)13-6-3-2-4-7-13/h2-12H,1H3