[4-(4-octoxyphenyl)phenyl] 4-(1-icosoxyethyl)benzoate

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 4-(1-icosoxyethyl)benzoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 4-(1-icosoxyethyl)benzoate CAS Name: 4-(1-eicosoxyethyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 4-(1-icosoxyethyl)benzoate Traditional Name: 4-(1-arachyloxyethyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C49H74O4 MolecularWeight: 727.10946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

InChI

InChI=1S/C49H74O4/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-22-23-25-26-40-51-42(3)43-28-30-46(31-29-43)49(50)53-48-38-34-45(35-39-48)44-32-36-47(37-33-44)52-41-27-24-11-9-7-5-2/h28-39,42H,4-27,40-41H2,1-3H3