3-bromanyl-3-phenyl-2-[4-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenoxy]propanoic acid

Systemtic Name: 3-bromanyl-3-phenyl-2-[4-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenoxy]propanoic acid Openeye Name: 2-[4-[4-(2-benzylbenzofuran-3-yl)phenyl]phenoxy]-3-bromo-3-phenyl-propanoic acid CAS Name: 3-bromo-3-phenyl-2-[4-[4-[2-(phenylmethyl)-3-benzofuranyl]phenyl]phenoxy]propanoic acid IUPAC Name: 2-[4-[4-(2-benzyl-1-benzofuran-3-yl)phenyl]phenoxy]-3-bromo-3-phenylpropanoic acid Traditional Name: 2-[4-[4-(2-benzylbenzofuran-3-yl)phenyl]phenoxy]-3-bromo-3-phenyl-propionic acid Formula: C36H27BrO4 MolecularWeight: 603.50118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C5=CC=C(C=C5)OC(C(C6=CC=CC=C6)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C5=CC=C(C=C5)OC(C(C6=CC=CC=C6)Br)C(=O)O

InChI

InChI=1S/C36H27BrO4/c37-34(28-11-5-2-6-12-28)35(36(38)39)40-29-21-19-26(20-22-29)25-15-17-27(18-16-25)33-30-13-7-8-14-31(30)41-32(33)23-24-9-3-1-4-10-24/h1-22,34-35H,23H2,(H,38,39)