(3E)-3-[[3-bromanyl-4-(dimethylamino)phenyl]methylidene]-5-(4-ethoxyphenyl)furan-2-one

Systemtic Name: (3E)-3-[[3-bromanyl-4-(dimethylamino)phenyl]methylidene]-5-(4-ethoxyphenyl)furan-2-one Openeye Name: (3E)-3-[[3-bromo-4-(dimethylamino)phenyl]methylene]-5-(4-ethoxyphenyl)furan-2-one CAS Name: (3E)-3-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-5-(4-ethoxyphenyl)-2-furanone IUPAC Name: (3E)-3-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-5-(4-ethoxyphenyl)furan-2-one Traditional Name: (3E)-3-[3-bromo-4-(dimethylamino)benzylidene]-5-p-phenetyl-furan-2-one Formula: C21H20BrNO3 MolecularWeight: 414.2924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=CC3=CC(=C(C=C3)N(C)C)Br)C(=O)O2

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C/C(=C\C3=CC(=C(C=C3)N(C)C)Br)/C(=O)O2

InChI

InChI=1S/C21H20BrNO3/c1-4-25-17-8-6-15(7-9-17)20-13-16(21(24)26-20)11-14-5-10-19(23(2)3)18(22)12-14/h5-13H,4H2,1-3H3/b16-11+