(2S)-2-(4-bromanyl-3-methyl-phenoxy)-3-methyl-butanoate

Systemtic Name: (2S)-2-(4-bromanyl-3-methyl-phenoxy)-3-methyl-butanoate Openeye Name: (2S)-2-(4-bromo-3-methyl-phenoxy)-3-methyl-butanoate CAS Name: (2S)-2-(4-bromo-3-methylphenoxy)-3-methylbutanoate IUPAC Name: (2S)-2-(4-bromo-3-methylphenoxy)-3-methylbutanoate Traditional Name: (2S)-2-(4-bromo-3-methyl-phenoxy)-3-methyl-butyrate Formula: C12H14BrO3- MolecularWeight: 286.14176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C(C)C)C(=O)[O-])Br

Isomeric SMILES

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

InChI

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