3-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-5-decoxy-benzoic acid

Systemtic Name: 3-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-5-decoxy-benzoic acid Openeye Name: 3-decoxy-5-[1-(2,3-dibenzyloxyphenyl)hexoxy]benzoic acid CAS Name: 3-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-5-decoxybenzoic acid IUPAC Name: 3-[1-[2,3-bis(phenylmethoxy)phenyl]hexoxy]-5-decoxybenzoic acid Traditional Name: 3-decoxy-5-[1-(2,3-dibenzoxyphenyl)hexoxy]benzoic acid Formula: C43H54O6 MolecularWeight: 666.88526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OC(CCCCC)C2=C(C(=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OC(CCCCC)C2=C(C(=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C43H54O6/c1-3-5-7-8-9-10-11-19-28-46-37-29-36(43(44)45)30-38(31-37)49-40(26-14-6-4-2)39-25-20-27-41(47-32-34-21-15-12-16-22-34)42(39)48-33-35-23-17-13-18-24-35/h12-13,15-18,20-25,27,29-31,40H,3-11,14,19,26,28,32-33H2,1-2H3,(H,44,45)