tridecyl 4-ethylbenzoate

Systemtic Name: tridecyl 4-ethylbenzoate Openeye Name: tridecyl 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid tridecyl ester IUPAC Name: tridecyl 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid tridecyl ester Formula: C22H36O2 MolecularWeight: 332.52004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)CC

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)CC

InChI

InChI=1S/C22H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-19-24-22(23)21-17-15-20(4-2)16-18-21/h15-18H,3-14,19H2,1-2H3