(2S)-2-(2-bromanyl-6-tert-butyl-4-methyl-phenoxy)-3-methyl-butanoate

Systemtic Name: (2S)-2-(2-bromanyl-6-tert-butyl-4-methyl-phenoxy)-3-methyl-butanoate Openeye Name: (2S)-2-(2-bromo-6-tert-butyl-4-methyl-phenoxy)-3-methyl-butanoate CAS Name: (2S)-2-(2-bromo-6-tert-butyl-4-methylphenoxy)-3-methylbutanoate IUPAC Name: (2S)-2-(2-bromo-6-tert-butyl-4-methylphenoxy)-3-methylbutanoate Traditional Name: (2S)-2-(2-bromo-6-tert-butyl-4-methyl-phenoxy)-3-methyl-butyrate Formula: C16H22BrO3- MolecularWeight: 342.24808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23BrO3/c1-9(2)13(15(18)19)20-14-11(16(4,5)6)7-10(3)8-12(14)17/h7-9,13H,1-6H3,(H,18,19)/p-1/t13-/m0/s1