propan-2-yl 4-oxidanyl-3-(2-oxidanyl-5-propan-2-yloxycarbonyl-phenyl)sulfanyl-benzoate

Systemtic Name: propan-2-yl 4-oxidanyl-3-(2-oxidanyl-5-propan-2-yloxycarbonyl-phenyl)sulfanyl-benzoate Openeye Name: isopropyl 4-hydroxy-3-(2-hydroxy-5-isopropoxycarbonyl-phenyl)sulfanyl-benzoate CAS Name: 4-hydroxy-3-[[2-hydroxy-5-[oxo(propan-2-yloxy)methyl]phenyl]thio]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-hydroxy-3-(2-hydroxy-5-propan-2-yloxycarbonylphenyl)sulfanylbenzoate Traditional Name: 4-hydroxy-3-[(2-hydroxy-5-isopropoxycarbonyl-phenyl)thio]benzoic acid isopropyl ester Formula: C20H22O6S MolecularWeight: 390.45008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=C(C=C1)O)SC2=C(C=CC(=C2)C(=O)OC(C)C)O

Isomeric SMILES

CC(C)OC(=O)C1=CC(=C(C=C1)O)SC2=C(C=CC(=C2)C(=O)OC(C)C)O

InChI

InChI=1S/C20H22O6S/c1-11(2)25-19(23)13-5-7-15(21)17(9-13)27-18-10-14(6-8-16(18)22)20(24)26-12(3)4/h5-12,21-22H,1-4H3