(2S)-2-(4-bromanyl-2,3-dimethyl-phenoxy)-2-phenyl-ethanoate

Systemtic Name: (2S)-2-(4-bromanyl-2,3-dimethyl-phenoxy)-2-phenyl-ethanoate Openeye Name: (2S)-2-(4-bromo-2,3-dimethyl-phenoxy)-2-phenyl-acetate CAS Name: (2S)-2-(4-bromo-2,3-dimethylphenoxy)-2-phenylacetate IUPAC Name: (2S)-2-(4-bromo-2,3-dimethylphenoxy)-2-phenylacetate Traditional Name: (2S)-2-(4-bromo-2,3-dimethyl-phenoxy)-2-phenyl-acetate Formula: C16H14BrO3- MolecularWeight: 334.18456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Br)OC(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1C)Br)O[C@@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C16H15BrO3/c1-10-11(2)14(9-8-13(10)17)20-15(16(18)19)12-6-4-3-5-7-12/h3-9,15H,1-2H3,(H,18,19)/p-1/t15-/m0/s1