2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-6-[2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethoxy]-1-benzofuran-3-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-6-[2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethoxy]-1-benzofuran-3-one Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylene]-6-[2-(4-ethylpiperazin-1-yl)-2-oxo-ethoxy]benzofuran-3-one CAS Name: 2-[(2-chloro-6-fluorophenyl)methylidene]-6-[2-(4-ethyl-1-piperazinyl)-2-oxoethoxy]-3-benzofuranone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylidene]-6-[2-(4-ethylpiperazin-1-yl)-2-oxoethoxy]-1-benzofuran-3-one Traditional Name: 2-(2-chloro-6-fluoro-benzylidene)-6-[2-(4-ethylpiperazino)-2-keto-ethoxy]coumaran-3-one Formula: C23H22ClFN2O4 MolecularWeight: 444.883183

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=CC=C4Cl)F)O3

Isomeric SMILES

CCN1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=CC=C4Cl)F)O3

InChI

InChI=1S/C23H22ClFN2O4/c1-2-26-8-10-27(11-9-26)22(28)14-30-15-6-7-16-20(12-15)31-21(23(16)29)13-17-18(24)4-3-5-19(17)25/h3-7,12-13H,2,8-11,14H2,1H3