ethyl 5-[4-(2-bromanylethanoyl)phenoxy]-2,2-dimethyl-pentanoate

Systemtic Name: ethyl 5-[4-(2-bromanylethanoyl)phenoxy]-2,2-dimethyl-pentanoate Openeye Name: ethyl 5-[4-(2-bromoacetyl)phenoxy]-2,2-dimethyl-pentanoate CAS Name: 5-[4-(2-bromo-1-oxoethyl)phenoxy]-2,2-dimethylpentanoic acid ethyl ester IUPAC Name: ethyl 5-[4-(2-bromoacetyl)phenoxy]-2,2-dimethylpentanoate Traditional Name: 5-[4-(2-bromoacetyl)phenoxy]-2,2-dimethyl-valeric acid ethyl ester Formula: C17H23BrO4 MolecularWeight: 371.26612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCOC1=CC=C(C=C1)C(=O)CBr

Isomeric SMILES

CCOC(=O)C(C)(C)CCCOC1=CC=C(C=C1)C(=O)CBr

InChI

InChI=1S/C17H23BrO4/c1-4-21-16(20)17(2,3)10-5-11-22-14-8-6-13(7-9-14)15(19)12-18/h6-9H,4-5,10-12H2,1-3H3