(2Z)-5-bromanyl-2-[(3-methoxy-4-pentoxy-phenyl)methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-5-bromanyl-2-[(3-methoxy-4-pentoxy-phenyl)methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5-bromo-2-[(3-methoxy-4-pentoxy-phenyl)methylene]benzofuran-3-one CAS Name: (2Z)-5-bromo-2-[(3-methoxy-4-pentoxyphenyl)methylidene]-3-benzofuranone IUPAC Name: (2Z)-5-bromo-2-[(3-methoxy-4-pentoxyphenyl)methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-2-(4-amoxy-3-methoxy-benzylidene)-5-bromo-coumaran-3-one Formula: C21H21BrO4 MolecularWeight: 417.29304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)Br)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)Br)OC

InChI

InChI=1S/C21H21BrO4/c1-3-4-5-10-25-18-8-6-14(11-19(18)24-2)12-20-21(23)16-13-15(22)7-9-17(16)26-20/h6-9,11-13H,3-5,10H2,1-2H3/b20-12-