2-[2-(1,3-benzoxazol-2-yl)-4-bromanyl-phenoxy]-2-phenyl-propanoic acid

Systemtic Name: 2-[2-(1,3-benzoxazol-2-yl)-4-bromanyl-phenoxy]-2-phenyl-propanoic acid Openeye Name: 2-[2-(1,3-benzoxazol-2-yl)-4-bromo-phenoxy]-2-phenyl-propanoic acid CAS Name: 2-[2-(1,3-benzoxazol-2-yl)-4-bromophenoxy]-2-phenylpropanoic acid IUPAC Name: 2-[2-(1,3-benzoxazol-2-yl)-4-bromophenoxy]-2-phenylpropanoic acid Traditional Name: 2-[2-(1,3-benzoxazol-2-yl)-4-bromo-phenoxy]-2-phenyl-propionic acid Formula: C22H16BrNO4 MolecularWeight: 438.27074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(=O)O)OC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C1=CC=CC=C1)(C(=O)O)OC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H16BrNO4/c1-22(21(25)26,14-7-3-2-4-8-14)28-18-12-11-15(23)13-16(18)20-24-17-9-5-6-10-19(17)27-20/h2-13H,1H3,(H,25,26)