3-octadecoxypropyl 4-(4-heptylphenyl)benzoate

Systemtic Name: 3-octadecoxypropyl 4-(4-heptylphenyl)benzoate Openeye Name: 3-octadecoxypropyl 4-(4-heptylphenyl)benzoate CAS Name: 4-(4-heptylphenyl)benzoic acid 3-octadecoxypropyl ester IUPAC Name: 3-octadecoxypropyl 4-(4-heptylphenyl)benzoate Traditional Name: 4-(4-heptylphenyl)benzoic acid 3-stearyloxypropyl ester Formula: C41H66O3 MolecularWeight: 606.96094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCCCC

InChI

InChI=1S/C41H66O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-21-23-34-43-35-24-36-44-41(42)40-32-30-39(31-33-40)38-28-26-37(27-29-38)25-22-20-8-6-4-2/h26-33H,3-25,34-36H2,1-2H3