(3Z)-3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-1,1-bis(oxidanylidene)thiochromen-4-one

Systemtic Name: (3Z)-3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-1,1-bis(oxidanylidene)thiochromen-4-one Openeye Name: (3Z)-3-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-1,1-dioxo-thiochromen-4-one CAS Name: (3Z)-3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-1,1-dioxo-1-benzothiopyran-4-one IUPAC Name: (3Z)-3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one Traditional Name: (3Z)-3-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-1,1-diketo-thiochromen-4-one Formula: C17H13BrO5S MolecularWeight: 409.25112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2CS(=O)(=O)C3=CC=CC=C3C2=O)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/2\CS(=O)(=O)C3=CC=CC=C3C2=O)Br)O

InChI

InChI=1S/C17H13BrO5S/c1-23-14-8-10(7-13(18)17(14)20)6-11-9-24(21,22)15-5-3-2-4-12(15)16(11)19/h2-8,20H,9H2,1H3/b11-6+