4-[6-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-2-oxidanyl-3-propyl-benzoic acid

Systemtic Name: 4-[6-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[6-(2,3-dibenzyloxyphenyl)hexoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[6-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[6-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[6-(2,3-dibenzoxyphenyl)hexoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C36H40O6 MolecularWeight: 568.6992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCCCC2=C(C(=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCCCC2=C(C(=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C36H40O6/c1-2-14-30-32(23-22-31(34(30)37)36(38)39)40-24-12-4-3-11-19-29-20-13-21-33(41-25-27-15-7-5-8-16-27)35(29)42-26-28-17-9-6-10-18-28/h5-10,13,15-18,20-23,37H,2-4,11-12,14,19,24-26H2,1H3,(H,38,39)