ethyl 4-[2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[2-(1,3-benzodioxol-5-ylmethylene)-3-oxo-benzofuran-6-yl]oxyacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-6-benzofuranyl]oxy]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-6-yl]oxy]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-keto-2-piperonylidene-coumaran-6-yl)oxyacetyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H24N2O8 MolecularWeight: 480.46666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3

InChI

InChI=1S/C25H24N2O8/c1-2-31-25(30)27-9-7-26(8-10-27)23(28)14-32-17-4-5-18-20(13-17)35-22(24(18)29)12-16-3-6-19-21(11-16)34-15-33-19/h3-6,11-13H,2,7-10,14-15H2,1H3