[4-(3-octadecoxypropanoyloxy)phenyl] 4-octoxybenzoate

Systemtic Name: [4-(3-octadecoxypropanoyloxy)phenyl] 4-octoxybenzoate Openeye Name: [4-(3-octadecoxypropanoyloxy)phenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [4-(3-octadecoxy-1-oxopropoxy)phenyl] ester IUPAC Name: [4-(3-octadecoxypropanoyloxy)phenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [4-(3-stearyloxypropanoyloxy)phenyl] ester Formula: C42H66O6 MolecularWeight: 666.96984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCC(=O)OC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCC(=O)OC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCC

InChI

InChI=1S/C42H66O6/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-34-45-36-33-41(43)47-39-29-31-40(32-30-39)48-42(44)37-25-27-38(28-26-37)46-35-24-22-10-8-6-4-2/h25-32H,3-24,33-36H2,1-2H3