2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-oxidanyl-1-benzofuran-3-one Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methylene]-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzofuran-3-one CAS Name: 2-[(5-bromo-2-methoxyphenyl)methylidene]-6-hydroxy-7-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-3-benzofuranone IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methylidene]-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1-benzofuran-3-one Traditional Name: 2-(5-bromo-2-methoxy-benzylidene)-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazino]methyl]coumaran-3-one Formula: C23H25BrN2O5 MolecularWeight: 489.359

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN4CCN(CC4)CCO

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN4CCN(CC4)CCO

InChI

InChI=1S/C23H25BrN2O5/c1-30-20-5-2-16(24)12-15(20)13-21-22(29)17-3-4-19(28)18(23(17)31-21)14-26-8-6-25(7-9-26)10-11-27/h2-5,12-13,27-28H,6-11,14H2,1H3