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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCCCCCCC

InChI

InChI=1S/C44H64O3/c1-4-6-8-10-12-13-14-15-16-17-18-19-21-23-38-24-26-40(27-25-38)41-32-34-43(35-33-41)47-44(45)42-30-28-39(29-31-42)37(3)46-36-22-20-11-9-7-5-2/h24-35,37H,4-23,36H2,1-3H3