[4-[4-(2-octyldecanoyloxy)phenyl]phenyl] 4-octoxybenzoate

Systemtic Name: [4-[4-(2-octyldecanoyloxy)phenyl]phenyl] 4-octoxybenzoate Openeye Name: [4-[4-(2-octyldecanoyloxy)phenyl]phenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [4-[4-(2-octyl-1-oxodecoxy)phenyl]phenyl] ester IUPAC Name: [4-[4-(2-octyldecanoyloxy)phenyl]phenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [4-[4-(2-octyldecanoyloxy)phenyl]phenyl] ester Formula: C45H64O5 MolecularWeight: 684.98666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCCC

InChI

InChI=1S/C45H64O5/c1-4-7-10-13-16-19-22-39(23-20-17-14-11-8-5-2)44(46)49-42-32-24-37(25-33-42)38-26-34-43(35-27-38)50-45(47)40-28-30-41(31-29-40)48-36-21-18-15-12-9-6-3/h24-35,39H,4-23,36H2,1-3H3