1-octadecoxypropyl 4-(4-heptylphenyl)benzoate

Systemtic Name: 1-octadecoxypropyl 4-(4-heptylphenyl)benzoate Openeye Name: 1-octadecoxypropyl 4-(4-heptylphenyl)benzoate CAS Name: 4-(4-heptylphenyl)benzoic acid 1-octadecoxypropyl ester IUPAC Name: 1-octadecoxypropyl 4-(4-heptylphenyl)benzoate Traditional Name: 4-(4-heptylphenyl)benzoic acid 1-stearyloxypropyl ester Formula: C41H66O3 MolecularWeight: 606.96094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(CC)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(CC)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCCCC

InChI

InChI=1S/C41H66O3/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-35-43-40(6-3)44-41(42)39-33-31-38(32-34-39)37-29-27-36(28-30-37)26-24-22-10-8-5-2/h27-34,40H,4-26,35H2,1-3H3