(2S)-3-(2-bromanyl-5-methoxy-phenyl)-2-methyl-propanoic acid

Systemtic Name: (2S)-3-(2-bromanyl-5-methoxy-phenyl)-2-methyl-propanoic acid Openeye Name: (2S)-3-(2-bromo-5-methoxy-phenyl)-2-methyl-propanoic acid CAS Name: (2S)-3-(2-bromo-5-methoxyphenyl)-2-methylpropanoic acid IUPAC Name: (2S)-3-(2-bromo-5-methoxyphenyl)-2-methylpropanoic acid Traditional Name: (2S)-3-(2-bromo-5-methoxy-phenyl)-2-methyl-propionic acid Formula: C11H13BrO3 MolecularWeight: 273.12312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrO3/c1-7(11(13)14)5-8-6-9(15-2)3-4-10(8)12/h3-4,6-7H,5H2,1-2H3,(H,13,14)/t7-/m0/s1