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

Systemtic Name: [7-(4-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] ethanoate Openeye Name: [2-oxo-7-(p-tolyl)-1,3-benzoxathiol-5-yl] acetate CAS Name: acetic acid [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] acetate Traditional Name: acetic acid [2-keto-7-(p-tolyl)-1,3-benzoxathiol-5-yl] ester Formula: C16H12O4S MolecularWeight: 300.32908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12O4S/c1-9-3-5-11(6-4-9)13-7-12(19-10(2)17)8-14-15(13)20-16(18)21-14/h3-8H,1-2H3