(2S)-2-(4-bromanyl-2-propan-2-yl-phenoxy)-2-phenyl-ethanoate

Systemtic Name: (2S)-2-(4-bromanyl-2-propan-2-yl-phenoxy)-2-phenyl-ethanoate Openeye Name: (2S)-2-(4-bromo-2-isopropyl-phenoxy)-2-phenyl-acetate CAS Name: (2S)-2-(4-bromo-2-propan-2-ylphenoxy)-2-phenylacetate IUPAC Name: (2S)-2-(4-bromo-2-propan-2-ylphenoxy)-2-phenylacetate Traditional Name: (2S)-2-(4-bromo-2-isopropyl-phenoxy)-2-phenyl-acetate Formula: C17H16BrO3- MolecularWeight: 348.21114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)Br)OC(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)Br)O[C@@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C17H17BrO3/c1-11(2)14-10-13(18)8-9-15(14)21-16(17(19)20)12-6-4-3-5-7-12/h3-11,16H,1-2H3,(H,19,20)/p-1/t16-/m0/s1