2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-7-[(4-ethylpiperazin-1-yl)methyl]-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-7-[(4-ethylpiperazin-1-yl)methyl]-6-oxidanyl-1-benzofuran-3-one Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylene]-7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-benzofuran-3-one CAS Name: 2-[(2-chloro-6-fluorophenyl)methylidene]-7-[(4-ethyl-1-piperazinyl)methyl]-6-hydroxy-3-benzofuranone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylidene]-7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-1-benzofuran-3-one Traditional Name: 2-(2-chloro-6-fluoro-benzylidene)-7-[(4-ethylpiperazino)methyl]-6-hydroxy-coumaran-3-one Formula: C22H22ClFN2O3 MolecularWeight: 416.873083

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C=CC3=C2OC(=CC4=C(C=CC=C4Cl)F)C3=O)O

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C=CC3=C2OC(=CC4=C(C=CC=C4Cl)F)C3=O)O

InChI

InChI=1S/C22H22ClFN2O3/c1-2-25-8-10-26(11-9-25)13-16-19(27)7-6-14-21(28)20(29-22(14)16)12-15-17(23)4-3-5-18(15)24/h3-7,12,27H,2,8-11,13H2,1H3