[(3S)-2-oxidanylideneoxolan-3-yl] 3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxylate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 3-[(4-chlorophenyl)sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-2-benzofurancarboxylic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[(4-chlorophenyl)thio]methyl]coumarilic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C20H15ClO5S MolecularWeight: 402.8481

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1OC(=O)C2=C(C3=CC=CC=C3O2)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1COC(=O)[C@H]1OC(=O)C2=C(C3=CC=CC=C3O2)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15ClO5S/c21-12-5-7-13(8-6-12)27-11-15-14-3-1-2-4-16(14)25-18(15)20(23)26-17-9-10-24-19(17)22/h1-8,17H,9-11H2/t17-/m0/s1