2-(3-bromanylphenoxy)-2-methyl-3-oxidanyl-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-(3-bromanylphenoxy)-2-methyl-3-oxidanyl-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-2-(3-bromophenoxy)-3-hydroxy-2-methyl-propanoic acid CAS Name: 2-(3-bromophenoxy)-3-hydroxy-2-methyl-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-(3-bromophenoxy)-3-hydroxy-2-methyl-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxyphenyl)-2-(3-bromophenoxy)-3-hydroxy-2-methyl-propionic acid Formula: C23H21BrO5 MolecularWeight: 457.31384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)OCC2=CC=CC=C2)O)(C(=O)O)OC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C(C1=CC=C(C=C1)OCC2=CC=CC=C2)O)(C(=O)O)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C23H21BrO5/c1-23(22(26)27,29-20-9-5-8-18(24)14-20)21(25)17-10-12-19(13-11-17)28-15-16-6-3-2-4-7-16/h2-14,21,25H,15H2,1H3,(H,26,27)