(3E)-3-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methylidene]-5-(4-methylphenyl)furan-2-one

Systemtic Name: (3E)-3-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methylidene]-5-(4-methylphenyl)furan-2-one Openeye Name: (3E)-3-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methylene]-5-(p-tolyl)furan-2-one CAS Name: (3E)-3-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-5-(4-methylphenyl)-2-furanone IUPAC Name: (3E)-3-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-5-(4-methylphenyl)furan-2-one Traditional Name: (3E)-3-(3-bromo-4-ethoxy-5-methoxy-benzylidene)-5-(p-tolyl)furan-2-one Formula: C21H19BrO4 MolecularWeight: 415.27716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=C2C=C(OC2=O)C3=CC=C(C=C3)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)/C=C/2\C=C(OC2=O)C3=CC=C(C=C3)C)OC

InChI

InChI=1S/C21H19BrO4/c1-4-25-20-17(22)10-14(11-19(20)24-3)9-16-12-18(26-21(16)23)15-7-5-13(2)6-8-15/h5-12H,4H2,1-3H3/b16-9+