ethyl 6-[3-(5-bromanylpentoxy)phenoxy]-2,2-dimethyl-hexanoate

Systemtic Name: ethyl 6-[3-(5-bromanylpentoxy)phenoxy]-2,2-dimethyl-hexanoate Openeye Name: ethyl 6-[3-(5-bromopentoxy)phenoxy]-2,2-dimethyl-hexanoate CAS Name: 6-[3-(5-bromopentoxy)phenoxy]-2,2-dimethylhexanoic acid ethyl ester IUPAC Name: ethyl 6-[3-(5-bromopentoxy)phenoxy]-2,2-dimethylhexanoate Traditional Name: 6-[3-(5-bromopentoxy)phenoxy]-2,2-dimethyl-hexanoic acid ethyl ester Formula: C21H33BrO4 MolecularWeight: 429.38832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCCOC1=CC=CC(=C1)OCCCCCBr

Isomeric SMILES

CCOC(=O)C(C)(C)CCCCOC1=CC=CC(=C1)OCCCCCBr

InChI

InChI=1S/C21H33BrO4/c1-4-24-20(23)21(2,3)13-6-9-16-26-19-12-10-11-18(17-19)25-15-8-5-7-14-22/h10-12,17H,4-9,13-16H2,1-3H3