(4-propylphenyl) 4-(4-octoxyphenyl)benzoate

Systemtic Name: (4-propylphenyl) 4-(4-octoxyphenyl)benzoate Openeye Name: (4-propylphenyl) 4-(4-octoxyphenyl)benzoate CAS Name: 4-(4-octoxyphenyl)benzoic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 4-(4-octoxyphenyl)benzoate Traditional Name: 4-(4-octoxyphenyl)benzoic acid (4-propylphenyl) ester Formula: C30H36O3 MolecularWeight: 444.60504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC

InChI

InChI=1S/C30H36O3/c1-3-5-6-7-8-9-23-32-28-21-17-26(18-22-28)25-13-15-27(16-14-25)30(31)33-29-19-11-24(10-4-2)12-20-29/h11-22H,3-10,23H2,1-2H3