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

Systemtic Name: (3Z)-3-[(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methylidene]-1,1-bis(oxidanylidene)thiochromen-4-one Openeye Name: (3Z)-3-[(3-bromo-5-ethoxy-4-methoxy-phenyl)methylene]-1,1-dioxo-thiochromen-4-one CAS Name: (3Z)-3-[(3-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-1,1-dioxo-1-benzothiopyran-4-one IUPAC Name: (3Z)-3-[(3-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one Traditional Name: (3Z)-3-(3-bromo-5-ethoxy-4-methoxy-benzylidene)-1,1-diketo-thiochromen-4-one Formula: C19H17BrO5S MolecularWeight: 437.30428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2CS(=O)(=O)C3=CC=CC=C3C2=O)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\CS(=O)(=O)C3=CC=CC=C3C2=O)Br)OC

InChI

InChI=1S/C19H17BrO5S/c1-3-25-16-10-12(9-15(20)19(16)24-2)8-13-11-26(22,23)17-7-5-4-6-14(17)18(13)21/h4-10H,3,11H2,1-2H3/b13-8+