(4-dodecylphenyl) 4-cyanobenzoate

Systemtic Name: (4-dodecylphenyl) 4-cyanobenzoate Openeye Name: (4-dodecylphenyl) 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (4-dodecylphenyl) ester IUPAC Name: (4-dodecylphenyl) 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (4-laurylphenyl) ester Formula: C26H33NO2 MolecularWeight: 391.54572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C26H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-22-15-19-25(20-16-22)29-26(28)24-17-13-23(21-27)14-18-24/h13-20H,2-12H2,1H3