methyl 5-[[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[4-[[(4-chlorophenyl)thio]methyl]benzoyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C21H17ClO5S MolecularWeight: 416.87468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClO5S/c1-25-21(24)19-11-8-17(27-19)12-26-20(23)15-4-2-14(3-5-15)13-28-18-9-6-16(22)7-10-18/h2-11H,12-13H2,1H3