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

Systemtic Name: 7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-oxidanyl-2-[(4-phenylphenyl)methylidene]-1-benzofuran-3-one Openeye Name: 6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-2-[(4-phenylphenyl)methylene]benzofuran-3-one CAS Name: 6-hydroxy-7-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-2-[(4-phenylphenyl)methylidene]-3-benzofuranone IUPAC Name: 6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-2-[(4-phenylphenyl)methylidene]-1-benzofuran-3-one Traditional Name: 6-hydroxy-7-[[4-(2-hydroxyethyl)piperazino]methyl]-2-(4-phenylbenzylidene)coumaran-3-one Formula: C28H28N2O4 MolecularWeight: 456.53292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)CC2=C(C=CC3=C2OC(=CC4=CC=C(C=C4)C5=CC=CC=C5)C3=O)O

Isomeric SMILES

C1CN(CCN1CCO)CC2=C(C=CC3=C2OC(=CC4=CC=C(C=C4)C5=CC=CC=C5)C3=O)O

InChI

InChI=1S/C28H28N2O4/c31-17-16-29-12-14-30(15-13-29)19-24-25(32)11-10-23-27(33)26(34-28(23)24)18-20-6-8-22(9-7-20)21-4-2-1-3-5-21/h1-11,18,31-32H,12-17,19H2