2-[(4-tert-butylphenyl)methylidene]-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylidene]-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-oxidanyl-1-benzofuran-3-one Openeye Name: 2-[(4-tert-butylphenyl)methylene]-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzofuran-3-one CAS Name: 2-[(4-tert-butylphenyl)methylidene]-6-hydroxy-7-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-3-benzofuranone IUPAC Name: 2-[(4-tert-butylphenyl)methylidene]-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1-benzofuran-3-one Traditional Name: 2-(4-tert-butylbenzylidene)-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazino]methyl]coumaran-3-one Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O4/c1-26(2,3)19-6-4-18(5-7-19)16-23-24(31)20-8-9-22(30)21(25(20)32-23)17-28-12-10-27(11-13-28)14-15-29/h4-9,16,29-30H,10-15,17H2,1-3H3