2,6,8-trimethylnonan-4-yl octadecanoate

Systemtic Name: 2,6,8-trimethylnonan-4-yl octadecanoate Openeye Name: (1-isobutyl-3,5-dimethyl-hexyl) octadecanoate CAS Name: octadecanoic acid 2,6,8-trimethylnonan-4-yl ester IUPAC Name: 2,6,8-trimethylnonan-4-yl octadecanoate Traditional Name: stearic acid (1-isobutyl-3,5-dimethyl-hexyl) ester Formula: C30H60O2 MolecularWeight: 452.7962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CC(C)C)CC(C)CC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CC(C)C)CC(C)CC(C)C

InChI

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