4-(2,6,8-trimethylnonyl)octadecanoate

Systemtic Name: 4-(2,6,8-trimethylnonyl)octadecanoate Openeye Name: 4-(2,6,8-trimethylnonyl)octadecanoate CAS Name: 4-(2,6,8-trimethylnonyl)octadecanoate IUPAC Name: 4-(2,6,8-trimethylnonyl)octadecanoate Traditional Name: 4-(2,6,8-trimethylnonyl)stearate Formula: C30H59O2- MolecularWeight: 451.78826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCC(=O)[O-])CC(C)CCCC(C)CC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCC(CCC(=O)[O-])CC(C)CCCC(C)CC(C)C

InChI

InChI=1S/C30H60O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-21-29(22-23-30(31)32)25-28(5)20-18-19-27(4)24-26(2)3/h26-29H,6-25H2,1-5H3,(H,31,32)/p-1