ethyl 8-(4-butylphenyl)-8-oxidanylidene-octanoate

Systemtic Name: ethyl 8-(4-butylphenyl)-8-oxidanylidene-octanoate Openeye Name: ethyl 8-(4-butylphenyl)-8-oxo-octanoate CAS Name: 8-(4-butylphenyl)-8-oxooctanoic acid ethyl ester IUPAC Name: ethyl 8-(4-butylphenyl)-8-oxooctanoate Traditional Name: 8-(4-butylphenyl)-8-keto-caprylic acid ethyl ester Formula: C20H30O3 MolecularWeight: 318.4504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CCCCCCC(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CCCCCCC(=O)OCC

InChI

InChI=1S/C20H30O3/c1-3-5-10-17-13-15-18(16-14-17)19(21)11-8-6-7-9-12-20(22)23-4-2/h13-16H,3-12H2,1-2H3