(4-octoxyphenyl) 4-pentylbenzoate

Systemtic Name: (4-octoxyphenyl) 4-pentylbenzoate Openeye Name: (4-octoxyphenyl) 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid (4-octoxyphenyl) ester IUPAC Name: (4-octoxyphenyl) 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid (4-octoxyphenyl) ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C26H36O3/c1-3-5-7-8-9-11-21-28-24-17-19-25(20-18-24)29-26(27)23-15-13-22(14-16-23)12-10-6-4-2/h13-20H,3-12,21H2,1-2H3