methyl 3-[4-(2-bromoethyl)phenyl]-2,2-dimethyl-propanoate

Systemtic Name: methyl 3-[4-(2-bromoethyl)phenyl]-2,2-dimethyl-propanoate Openeye Name: methyl 3-[4-(2-bromoethyl)phenyl]-2,2-dimethyl-propanoate CAS Name: 3-[4-(2-bromoethyl)phenyl]-2,2-dimethylpropanoic acid methyl ester IUPAC Name: methyl 3-[4-(2-bromoethyl)phenyl]-2,2-dimethylpropanoate Traditional Name: 3-[4-(2-bromoethyl)phenyl]-2,2-dimethyl-propionic acid methyl ester Formula: C14H19BrO2 MolecularWeight: 299.20346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)CCBr)C(=O)OC

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)CCBr)C(=O)OC

InChI

InChI=1S/C14H19BrO2/c1-14(2,13(16)17-3)10-12-6-4-11(5-7-12)8-9-15/h4-7H,8-10H2,1-3H3