3-(2-bromanyl-4,6-dimethyl-phenoxy)propanoic acid

Systemtic Name: 3-(2-bromanyl-4,6-dimethyl-phenoxy)propanoic acid Openeye Name: 3-(2-bromo-4,6-dimethyl-phenoxy)propanoic acid CAS Name: 3-(2-bromo-4,6-dimethylphenoxy)propanoic acid IUPAC Name: 3-(2-bromo-4,6-dimethylphenoxy)propanoic acid Traditional Name: 3-(2-bromo-4,6-dimethyl-phenoxy)propionic acid Formula: C11H13BrO3 MolecularWeight: 273.12312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCC(=O)O)C

InChI

InChI=1S/C11H13BrO3/c1-7-5-8(2)11(9(12)6-7)15-4-3-10(13)14/h5-6H,3-4H2,1-2H3,(H,13,14)