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

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 4-(1-octadecoxyethyl)benzoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 4-(1-octadecoxyethyl)benzoate CAS Name: 4-(1-octadecoxyethyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 4-(1-octadecoxyethyl)benzoate Traditional Name: 4-(1-stearyloxyethyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C47H70O4 MolecularWeight: 699.0563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

InChI

InChI=1S/C47H70O4/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-23-24-38-49-40(3)41-26-28-44(29-27-41)47(48)51-46-36-32-43(33-37-46)42-30-34-45(35-31-42)50-39-25-22-11-9-7-5-2/h26-37,40H,4-25,38-39H2,1-3H3