6-(3-chloranyl-4-methoxy-phenyl)-2-oxidanyl-3-(phenylmethylsulfanyl)pyran-4-one

Systemtic Name: 6-(3-chloranyl-4-methoxy-phenyl)-2-oxidanyl-3-(phenylmethylsulfanyl)pyran-4-one Openeye Name: 3-benzylsulfanyl-6-(3-chloro-4-methoxy-phenyl)-2-hydroxy-pyran-4-one CAS Name: 6-(3-chloro-4-methoxyphenyl)-2-hydroxy-3-(phenylmethylthio)-4-pyranone IUPAC Name: 3-benzylsulfanyl-6-(3-chloro-4-methoxyphenyl)-2-hydroxypyran-4-one Traditional Name: 3-(benzylthio)-6-(3-chloro-4-methoxy-phenyl)-2-hydroxy-pyran-4-one Formula: C19H15ClO4S MolecularWeight: 374.838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=O)C(=C(O2)O)SCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=O)C(=C(O2)O)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H15ClO4S/c1-23-16-8-7-13(9-14(16)20)17-10-15(21)18(19(22)24-17)25-11-12-5-3-2-4-6-12/h2-10,22H,11H2,1H3