[4-[4-(1-octadecoxyethyl)phenyl]phenyl] 4-dodecylbenzoate

Systemtic Name: [4-[4-(1-octadecoxyethyl)phenyl]phenyl] 4-dodecylbenzoate Openeye Name: [4-[4-(1-octadecoxyethyl)phenyl]phenyl] 4-dodecylbenzoate CAS Name: 4-dodecylbenzoic acid [4-[4-(1-octadecoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-octadecoxyethyl)phenyl]phenyl] 4-dodecylbenzoate Traditional Name: 4-laurylbenzoic acid [4-[4-(1-stearyloxyethyl)phenyl]phenyl] ester Formula: C51H78O3 MolecularWeight: 739.16322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCCCCCCC

InChI

InChI=1S/C51H78O3/c1-4-6-8-10-12-14-16-17-18-19-20-21-23-25-27-29-43-53-44(3)46-35-37-47(38-36-46)48-39-41-50(42-40-48)54-51(52)49-33-31-45(32-34-49)30-28-26-24-22-15-13-11-9-7-5-2/h31-42,44H,4-30,43H2,1-3H3