3-[5-bromanyl-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]propanoic acid

Systemtic Name: 3-[5-bromanyl-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]propanoic acid Openeye Name: 3-[5-bromo-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]propanoic acid CAS Name: 3-[5-bromo-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]propanoic acid IUPAC Name: 3-[5-bromo-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]propanoic acid Traditional Name: 3-[5-bromo-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]propionic acid Formula: C19H21BrO4 MolecularWeight: 393.27164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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