methyl 5-(3-methoxycarbonyl-4-oxidanyl-phenyl)sulfanyl-2-oxidanyl-benzoate

Systemtic Name: methyl 5-(3-methoxycarbonyl-4-oxidanyl-phenyl)sulfanyl-2-oxidanyl-benzoate Openeye Name: methyl 2-hydroxy-5-(4-hydroxy-3-methoxycarbonyl-phenyl)sulfanyl-benzoate CAS Name: 2-hydroxy-5-[(4-hydroxy-3-methoxycarbonylphenyl)thio]benzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-5-(4-hydroxy-3-methoxycarbonylphenyl)sulfanylbenzoate Traditional Name: 5-[(3-carbomethoxy-4-hydroxy-phenyl)thio]-2-hydroxy-benzoic acid methyl ester Formula: C16H14O6S MolecularWeight: 334.34376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14O6S/c1-21-15(19)11-7-9(3-5-13(11)17)23-10-4-6-14(18)12(8-10)16(20)22-2/h3-8,17-18H,1-2H3