[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 5-chloranyl-2-methoxy-benzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 5-chloranyl-2-methoxy-benzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 5-chloro-2-methoxy-benzoate CAS Name: 5-chloro-2-methoxybenzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 5-chloro-2-methoxybenzoate Traditional Name: 5-chloro-2-methoxy-benzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C17H15ClO4S MolecularWeight: 350.8166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)OCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)OCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C17H15ClO4S/c1-21-16-8-5-12(18)9-14(16)17(20)22-10-15(19)11-3-6-13(23-2)7-4-11/h3-9H,10H2,1-2H3