(2S)-2-(2-bromanyl-4-methyl-phenoxy)-3-methyl-butanoic acid

Systemtic Name: (2S)-2-(2-bromanyl-4-methyl-phenoxy)-3-methyl-butanoic acid Openeye Name: (2S)-2-(2-bromo-4-methyl-phenoxy)-3-methyl-butanoic acid CAS Name: (2S)-2-(2-bromo-4-methylphenoxy)-3-methylbutanoic acid IUPAC Name: (2S)-2-(2-bromo-4-methylphenoxy)-3-methylbutanoic acid Traditional Name: (2S)-2-(2-bromo-4-methyl-phenoxy)-3-methyl-butyric acid Formula: C12H15BrO3 MolecularWeight: 287.1497

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@@H](C(C)C)C(=O)O)Br

InChI

InChI=1S/C12H15BrO3/c1-7(2)11(12(14)15)16-10-5-4-8(3)6-9(10)13/h4-7,11H,1-3H3,(H,14,15)/t11-/m0/s1