(2-oxidanylidene-7-phenyl-1,3-benzoxathiol-5-yl) 3-methoxybenzoate

Systemtic Name: (2-oxidanylidene-7-phenyl-1,3-benzoxathiol-5-yl) 3-methoxybenzoate Openeye Name: (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) ester IUPAC Name: (2-oxo-7-phenyl-1,3-benzoxathiol-5-yl) 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid (2-keto-7-phenyl-1,3-benzoxathiol-5-yl) ester Formula: C21H14O5S MolecularWeight: 378.39786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC=CC=C4)OC(=O)S3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC=CC=C4)OC(=O)S3

InChI

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