4-[[4-bromanyl-2-[(E)-4-(diethylamino)-4-oxidanylidene-but-2-en-2-yl]-1-benzofuran-7-yl]oxy]butanoic acid

Systemtic Name: 4-[[4-bromanyl-2-[(E)-4-(diethylamino)-4-oxidanylidene-but-2-en-2-yl]-1-benzofuran-7-yl]oxy]butanoic acid Openeye Name: 4-[4-bromo-2-[(E)-3-(diethylamino)-1-methyl-3-oxo-prop-1-enyl]benzofuran-7-yl]oxybutanoic acid CAS Name: 4-[[4-bromo-2-[(E)-4-(diethylamino)-4-oxobut-2-en-2-yl]-7-benzofuranyl]oxy]butanoic acid IUPAC Name: 4-[[4-bromo-2-[(E)-4-(diethylamino)-4-oxobut-2-en-2-yl]-1-benzofuran-7-yl]oxy]butanoic acid Traditional Name: 4-[4-bromo-2-[(E)-3-(diethylamino)-3-keto-1-methyl-prop-1-enyl]benzofuran-7-yl]oxybutyric acid Formula: C20H24BrNO5 MolecularWeight: 438.31226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C=C(C)C1=CC2=C(C=CC(=C2O1)OCCCC(=O)O)Br

Isomeric SMILES

CCN(CC)C(=O)/C=C(\C)/C1=CC2=C(C=CC(=C2O1)OCCCC(=O)O)Br

InChI

InChI=1S/C20H24BrNO5/c1-4-22(5-2)18(23)11-13(3)17-12-14-15(21)8-9-16(20(14)27-17)26-10-6-7-19(24)25/h8-9,11-12H,4-7,10H2,1-3H3,(H,24,25)/b13-11+