propan-2-yl 2-[[5-oxidanyl-3-(phenylcarbonyl)-1-benzofuran-2-yl]methylsulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[[5-oxidanyl-3-(phenylcarbonyl)-1-benzofuran-2-yl]methylsulfanyl]ethanoate Openeye Name: isopropyl 2-[(3-benzoyl-5-hydroxy-benzofuran-2-yl)methylsulfanyl]acetate CAS Name: 2-[(3-benzoyl-5-hydroxy-2-benzofuranyl)methylthio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-benzoyl-5-hydroxy-1-benzofuran-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(3-benzoyl-5-hydroxy-benzofuran-2-yl)methylthio]acetic acid isopropyl ester Formula: C21H20O5S MolecularWeight: 384.4455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSCC1=C(C2=C(O1)C=CC(=C2)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)CSCC1=C(C2=C(O1)C=CC(=C2)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20O5S/c1-13(2)25-19(23)12-27-11-18-20(21(24)14-6-4-3-5-7-14)16-10-15(22)8-9-17(16)26-18/h3-10,13,22H,11-12H2,1-2H3