(2Z)-2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-5,6-dimethyl-1-benzofuran-3-one

Systemtic Name: (2Z)-2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-5,6-dimethyl-1-benzofuran-3-one Openeye Name: (2Z)-2-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-5,6-dimethyl-benzofuran-3-one CAS Name: (2Z)-2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-5,6-dimethyl-3-benzofuranone IUPAC Name: (2Z)-2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-5,6-dimethyl-1-benzofuran-3-one Traditional Name: (2Z)-2-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-5,6-dimethyl-coumaran-3-one Formula: C18H15BrO4 MolecularWeight: 375.2133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)O2)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)/C(=C/C3=CC(=C(C(=C3)Br)O)OC)/O2)C

InChI

InChI=1S/C18H15BrO4/c1-9-4-12-14(5-10(9)2)23-16(17(12)20)8-11-6-13(19)18(21)15(7-11)22-3/h4-8,21H,1-3H3/b16-8-