3-[5-bromanyl-2-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]propanoate

Systemtic Name: 3-[5-bromanyl-2-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]propanoate Openeye Name: 3-[5-bromo-2-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]propanoate CAS Name: 3-[5-bromo-2-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]propanoate IUPAC Name: 3-[5-bromo-2-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]propanoate Traditional Name: 3-[5-bromo-2-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]propionate Formula: C19H20BrO4- MolecularWeight: 392.2637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCOC2=C(C=C(C=C2)Br)CCC(=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCOC2=C(C=C(C=C2)Br)CCC(=O)[O-])C

InChI

InChI=1S/C19H21BrO4/c1-13-4-3-5-17(14(13)2)23-10-11-24-18-8-7-16(20)12-15(18)6-9-19(21)22/h3-5,7-8,12H,6,9-11H2,1-2H3,(H,21,22)/p-1