3-methoxy-3-(4-methylphenyl)sulfanyl-2-benzofuran-1-one

Systemtic Name: 3-methoxy-3-(4-methylphenyl)sulfanyl-2-benzofuran-1-one Openeye Name: 3-methoxy-3-(p-tolylsulfanyl)isobenzofuran-1-one CAS Name: 3-methoxy-3-[(4-methylphenyl)thio]-1-isobenzofuranone IUPAC Name: 3-methoxy-3-(4-methylphenyl)sulfanyl-2-benzofuran-1-one Traditional Name: 3-methoxy-3-(p-tolylthio)phthalide Formula: C16H14O3S MolecularWeight: 286.34556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2(C3=CC=CC=C3C(=O)O2)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2(C3=CC=CC=C3C(=O)O2)OC

InChI

InChI=1S/C16H14O3S/c1-11-7-9-12(10-8-11)20-16(18-2)14-6-4-3-5-13(14)15(17)19-16/h3-10H,1-2H3