[4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate

Systemtic Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate Openeye Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate CAS Name: 4-pentadecylbenzoic acid [4-[4-(1-eicosoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-icosoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate Traditional Name: 4-pentadecylbenzoic acid [4-[4-(1-arachyloxyethyl)phenyl]phenyl] ester Formula: C56H88O3 MolecularWeight: 809.29612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCCCCCCCCCC

InChI

InChI=1S/C56H88O3/c1-4-6-8-10-12-14-16-18-19-20-21-22-24-26-28-30-32-34-48-58-49(3)51-40-42-52(43-41-51)53-44-46-55(47-45-53)59-56(57)54-38-36-50(37-39-54)35-33-31-29-27-25-23-17-15-13-11-9-7-5-2/h36-47,49H,4-35,48H2,1-3H3