4-oxidanylidene-4-[[2-oxidanyl-5-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[2-oxidanyl-5-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenyl]amino]butanoic acid Openeye Name: 4-[5-[4-(2-benzylbenzofuran-3-yl)phenyl]-2-hydroxy-anilino]-4-oxo-butanoic acid CAS Name: 4-[2-hydroxy-5-[4-[2-(phenylmethyl)-3-benzofuranyl]phenyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[5-[4-(2-benzyl-1-benzofuran-3-yl)phenyl]-2-hydroxyanilino]-4-oxobutanoic acid Traditional Name: 4-[5-[4-(2-benzylbenzofuran-3-yl)phenyl]-2-hydroxy-anilino]-4-keto-butyric acid Formula: C31H25NO5 MolecularWeight: 491.5339

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C5=CC(=C(C=C5)O)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C5=CC(=C(C=C5)O)NC(=O)CCC(=O)O

InChI

InChI=1S/C31H25NO5/c33-26-15-14-23(19-25(26)32-29(34)16-17-30(35)36)21-10-12-22(13-11-21)31-24-8-4-5-9-27(24)37-28(31)18-20-6-2-1-3-7-20/h1-15,19,33H,16-18H2,(H,32,34)(H,35,36)