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

Systemtic Name: 2-[[2-[(E)-4-(diethylamino)-4-oxidanylidene-but-2-en-2-yl]-1-benzofuran-7-yl]oxy]butanoate Openeye Name: 2-[2-[(E)-3-(diethylamino)-1-methyl-3-oxo-prop-1-enyl]benzofuran-7-yl]oxybutanoate CAS Name: 2-[[2-[(E)-4-(diethylamino)-4-oxobut-2-en-2-yl]-7-benzofuranyl]oxy]butanoate IUPAC Name: 2-[[2-[(E)-4-(diethylamino)-4-oxobut-2-en-2-yl]-1-benzofuran-7-yl]oxy]butanoate Traditional Name: 2-[2-[(E)-3-(diethylamino)-3-keto-1-methyl-prop-1-enyl]benzofuran-7-yl]oxybutyrate Formula: C20H24NO5- MolecularWeight: 358.40826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC1=CC=CC2=C1OC(=C2)C(=CC(=O)N(CC)CC)C

Isomeric SMILES

CCC(C(=O)[O-])OC1=CC=CC2=C1OC(=C2)/C(=C/C(=O)N(CC)CC)/C

InChI

InChI=1S/C20H25NO5/c1-5-15(20(23)24)25-16-10-8-9-14-12-17(26-19(14)16)13(4)11-18(22)21(6-2)7-3/h8-12,15H,5-7H2,1-4H3,(H,23,24)/p-1/b13-11+