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

Systemtic Name: (2S)-2-(2-bromanyl-4-tert-butyl-phenoxy)-3-methyl-butanoate Openeye Name: (2S)-2-(2-bromo-4-tert-butyl-phenoxy)-3-methyl-butanoate CAS Name: (2S)-2-(2-bromo-4-tert-butylphenoxy)-3-methylbutanoate IUPAC Name: (2S)-2-(2-bromo-4-tert-butylphenoxy)-3-methylbutanoate Traditional Name: (2S)-2-(2-bromo-4-tert-butyl-phenoxy)-3-methyl-butyrate Formula: C15H20BrO3- MolecularWeight: 328.2215

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])OC1=C(C=C(C=C1)C(C)(C)C)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])OC1=C(C=C(C=C1)C(C)(C)C)Br

InChI

InChI=1S/C15H21BrO3/c1-9(2)13(14(17)18)19-12-7-6-10(8-11(12)16)15(3,4)5/h6-9,13H,1-5H3,(H,17,18)/p-1/t13-/m0/s1