methyl 2-[4-(4-bromanylbutoxy)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(4-bromanylbutoxy)phenyl]ethanoate Openeye Name: methyl 2-[4-(4-bromobutoxy)phenyl]acetate CAS Name: 2-[4-(4-bromobutoxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-bromobutoxy)phenyl]acetate Traditional Name: 2-[4-(4-bromobutoxy)phenyl]acetic acid methyl ester Formula: C13H17BrO3 MolecularWeight: 301.17628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)OCCCCBr

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)OCCCCBr

InChI

InChI=1S/C13H17BrO3/c1-16-13(15)10-11-4-6-12(7-5-11)17-9-3-2-8-14/h4-7H,2-3,8-10H2,1H3