2,5-bis[3-oxidanyl-4-(phenylcarbonyl)phenoxy]pentanoic acid

Systemtic Name: 2,5-bis[3-oxidanyl-4-(phenylcarbonyl)phenoxy]pentanoic acid Openeye Name: 2,5-bis(4-benzoyl-3-hydroxy-phenoxy)pentanoic acid CAS Name: 2,5-bis(4-benzoyl-3-hydroxyphenoxy)pentanoic acid IUPAC Name: 2,5-bis(4-benzoyl-3-hydroxyphenoxy)pentanoic acid Traditional Name: 2,5-bis(4-benzoyl-3-hydroxy-phenoxy)valeric acid Formula: C31H26O8 MolecularWeight: 526.53334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCCC(C(=O)O)OC3=CC(=C(C=C3)C(=O)C4=CC=CC=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCCC(C(=O)O)OC3=CC(=C(C=C3)C(=O)C4=CC=CC=C4)O)O

InChI

InChI=1S/C31H26O8/c32-26-18-22(13-15-24(26)29(34)20-8-3-1-4-9-20)38-17-7-12-28(31(36)37)39-23-14-16-25(27(33)19-23)30(35)21-10-5-2-6-11-21/h1-6,8-11,13-16,18-19,28,32-33H,7,12,17H2,(H,36,37)