(2-pentadecylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate

Systemtic Name: (2-pentadecylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate Openeye Name: (2-pentadecylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-octoxyethyl)phenyl]benzoic acid (2-pentadecylphenyl) ester IUPAC Name: (2-pentadecylphenyl) 4-[4-(1-octoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-octoxyethyl)phenyl]benzoic acid (2-pentadecylphenyl) ester Formula: C44H64O3 MolecularWeight: 640.97716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCCCC

InChI

InChI=1S/C44H64O3/c1-4-6-8-10-12-13-14-15-16-17-18-19-21-25-41-26-22-23-27-43(41)47-44(45)42-34-32-40(33-35-42)39-30-28-38(29-31-39)37(3)46-36-24-20-11-9-7-5-2/h22-23,26-35,37H,4-21,24-25,36H2,1-3H3