(3Z)-3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-6-fluoranyl-thiochromen-4-one

Systemtic Name: (3Z)-3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-6-fluoranyl-thiochromen-4-one Openeye Name: (3Z)-3-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-6-fluoro-thiochroman-4-one CAS Name: (3Z)-3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-6-fluoro-1-benzothiopyran-4-one IUPAC Name: (3Z)-3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-6-fluorothiochromen-4-one Traditional Name: (3Z)-3-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-6-fluoro-thiochroman-4-one Formula: C17H12BrFO3S MolecularWeight: 395.242783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2CSC3=C(C2=O)C=C(C=C3)F)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/2\CSC3=C(C2=O)C=C(C=C3)F)Br)O

InChI

InChI=1S/C17H12BrFO3S/c1-22-14-6-9(5-13(18)17(14)21)4-10-8-23-15-3-2-11(19)7-12(15)16(10)20/h2-7,21H,8H2,1H3/b10-4+