2-[1-bromanyl-6-[[(2-butyl-1-benzofuran-3-yl)carbonyl-methyl-amino]methyl]naphthalen-2-yl]oxy-3-phenyl-propanoic acid

Systemtic Name: 2-[1-bromanyl-6-[[(2-butyl-1-benzofuran-3-yl)carbonyl-methyl-amino]methyl]naphthalen-2-yl]oxy-3-phenyl-propanoic acid Openeye Name: 2-[[1-bromo-6-[[(2-butylbenzofuran-3-carbonyl)-methyl-amino]methyl]-2-naphthyl]oxy]-3-phenyl-propanoic acid CAS Name: 2-[[1-bromo-6-[[[(2-butyl-3-benzofuranyl)-oxomethyl]-methylamino]methyl]-2-naphthalenyl]oxy]-3-phenylpropanoic acid IUPAC Name: 2-[1-bromo-6-[[(2-butyl-1-benzofuran-3-carbonyl)-methylamino]methyl]naphthalen-2-yl]oxy-3-phenylpropanoic acid Traditional Name: 2-[1-bromo-6-[[(2-butylbenzofuran-3-carbonyl)-methyl-amino]methyl]-2-naphthoxy]-3-phenyl-propionic acid Formula: C34H32BrNO5 MolecularWeight: 614.52558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C(=O)N(C)CC3=CC4=C(C=C3)C(=C(C=C4)OC(CC5=CC=CC=C5)C(=O)O)Br

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)N(C)CC3=CC4=C(C=C3)C(=C(C=C4)OC(CC5=CC=CC=C5)C(=O)O)Br

InChI

InChI=1S/C34H32BrNO5/c1-3-4-13-28-31(26-12-8-9-14-27(26)40-28)33(37)36(2)21-23-15-17-25-24(19-23)16-18-29(32(25)35)41-30(34(38)39)20-22-10-6-5-7-11-22/h5-12,14-19,30H,3-4,13,20-21H2,1-2H3,(H,38,39)