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

Systemtic Name: [7-(4-methylphenyl)-2-oxidanylidene-1,3-benzoxathiol-5-yl] pentanoate Openeye Name: [2-oxo-7-(p-tolyl)-1,3-benzoxathiol-5-yl] pentanoate CAS Name: pentanoic acid [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] ester IUPAC Name: [7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl] pentanoate Traditional Name: valeric acid [2-keto-7-(p-tolyl)-1,3-benzoxathiol-5-yl] ester Formula: C19H18O4S MolecularWeight: 342.40882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC2=C(C(=C1)C3=CC=C(C=C3)C)OC(=O)S2

Isomeric SMILES

CCCCC(=O)OC1=CC2=C(C(=C1)C3=CC=C(C=C3)C)OC(=O)S2

InChI

InChI=1S/C19H18O4S/c1-3-4-5-17(20)22-14-10-15(13-8-6-12(2)7-9-13)18-16(11-14)24-19(21)23-18/h6-11H,3-5H2,1-2H3