phenyl 4-dodecylbenzoate

Systemtic Name: phenyl 4-dodecylbenzoate Openeye Name: phenyl 4-dodecylbenzoate CAS Name: 4-dodecylbenzoic acid phenyl ester IUPAC Name: phenyl 4-dodecylbenzoate Traditional Name: 4-laurylbenzoic acid phenyl ester Formula: C25H34O2 MolecularWeight: 366.53626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C25H34O2/c1-2-3-4-5-6-7-8-9-10-12-15-22-18-20-23(21-19-22)25(26)27-24-16-13-11-14-17-24/h11,13-14,16-21H,2-10,12,15H2,1H3