(2S)-2-[4-[(1S)-1-bromanyl-2-methyl-propyl]phenyl]propanoic acid

Systemtic Name: (2S)-2-[4-[(1S)-1-bromanyl-2-methyl-propyl]phenyl]propanoic acid Openeye Name: (2S)-2-[4-[(1S)-1-bromo-2-methyl-propyl]phenyl]propanoic acid CAS Name: (2S)-2-[4-[(1S)-1-bromo-2-methylpropyl]phenyl]propanoic acid IUPAC Name: (2S)-2-[4-[(1S)-1-bromo-2-methylpropyl]phenyl]propanoic acid Traditional Name: (2S)-2-[4-[(1S)-1-bromo-2-methyl-propyl]phenyl]propionic acid Formula: C13H17BrO2 MolecularWeight: 285.17688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrO2/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13(15)16/h4-9,12H,1-3H3,(H,15,16)/t9-,12-/m0/s1