[4-(1-octadecoxyethyl)phenyl] 4-(4-hexoxyphenyl)benzoate

Systemtic Name: [4-(1-octadecoxyethyl)phenyl] 4-(4-hexoxyphenyl)benzoate Openeye Name: [4-(1-octadecoxyethyl)phenyl] 4-(4-hexoxyphenyl)benzoate CAS Name: 4-(4-hexoxyphenyl)benzoic acid [4-(1-octadecoxyethyl)phenyl] ester IUPAC Name: [4-(1-octadecoxyethyl)phenyl] 4-(4-hexoxyphenyl)benzoate Traditional Name: 4-(4-hexoxyphenyl)benzoic acid [4-(1-stearyloxyethyl)phenyl] ester Formula: C45H66O4 MolecularWeight: 671.00314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C45H66O4/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-21-23-36-47-38(3)39-28-34-44(35-29-39)49-45(46)42-26-24-40(25-27-42)41-30-32-43(33-31-41)48-37-22-9-7-5-2/h24-35,38H,4-23,36-37H2,1-3H3