(1-chloranyl-2-methyl-1-oxidanylidene-propan-2-yl) docosanoate

Systemtic Name: (1-chloranyl-2-methyl-1-oxidanylidene-propan-2-yl) docosanoate Openeye Name: (2-chloro-1,1-dimethyl-2-oxo-ethyl) docosanoate CAS Name: docosanoic acid (1-chloro-2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (1-chloro-2-methyl-1-oxopropan-2-yl) docosanoate Traditional Name: behenic acid (2-chloro-2-keto-1,1-dimethyl-ethyl) ester Formula: C26H49ClO3 MolecularWeight: 445.11846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)(C)C(=O)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)(C)C(=O)Cl

InChI

InChI=1S/C26H49ClO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(28)30-26(2,3)25(27)29/h4-23H2,1-3H3