3-[8-oxidanyl-8-oxidanylidene-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxybenzoic acid

Systemtic Name: 3-[8-oxidanyl-8-oxidanylidene-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxybenzoic acid Openeye Name: 3-[6-hydroxy-6-oxo-1-[2-[2-(5-phenylpentoxy)phenyl]ethyl]hexoxy]benzoic acid CAS Name: 3-[8-hydroxy-8-oxo-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxybenzoic acid IUPAC Name: 3-[8-hydroxy-8-oxo-1-[2-(5-phenylpentoxy)phenyl]octan-3-yl]oxybenzoic acid Traditional Name: 3-[6-hydroxy-6-keto-1-[2-[2-(5-phenylpentoxy)phenyl]ethyl]hexoxy]benzoic acid Formula: C32H38O6 MolecularWeight: 518.64052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCOC2=CC=CC=C2CCC(CCCCC(=O)O)OC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCOC2=CC=CC=C2CCC(CCCCC(=O)O)OC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C32H38O6/c33-31(34)20-9-7-17-28(38-29-18-11-16-27(24-29)32(35)36)22-21-26-15-6-8-19-30(26)37-23-10-2-5-14-25-12-3-1-4-13-25/h1,3-4,6,8,11-13,15-16,18-19,24,28H,2,5,7,9-10,14,17,20-23H2,(H,33,34)(H,35,36)