(2-octylphenyl) 4-[4-(1-icosoxyethyl)phenyl]benzoate

Systemtic Name: (2-octylphenyl) 4-[4-(1-icosoxyethyl)phenyl]benzoate Openeye Name: (2-octylphenyl) 4-[4-(1-icosoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-eicosoxyethyl)phenyl]benzoic acid (2-octylphenyl) ester IUPAC Name: (2-octylphenyl) 4-[4-(1-icosoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-arachyloxyethyl)phenyl]benzoic acid (2-octylphenyl) ester Formula: C49H74O3 MolecularWeight: 711.11006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CCCCCCCC

InChI

InChI=1S/C49H74O3/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-22-23-25-29-41-51-42(3)43-33-35-44(36-34-43)45-37-39-47(40-38-45)49(50)52-48-32-28-27-31-46(48)30-26-24-11-9-7-5-2/h27-28,31-40,42H,4-26,29-30,41H2,1-3H3