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

Systemtic Name: 2-[1-bromanyl-6-[[(3-butyl-1-benzofuran-2-yl)carbonyl-methyl-amino]methyl]naphthalen-2-yl]oxyethanoic acid Openeye Name: 2-[[1-bromo-6-[[(3-butylbenzofuran-2-carbonyl)-methyl-amino]methyl]-2-naphthyl]oxy]acetic acid CAS Name: 2-[[1-bromo-6-[[[(3-butyl-2-benzofuranyl)-oxomethyl]-methylamino]methyl]-2-naphthalenyl]oxy]acetic acid IUPAC Name: 2-[1-bromo-6-[[(3-butyl-1-benzofuran-2-carbonyl)-methylamino]methyl]naphthalen-2-yl]oxyacetic acid Traditional Name: 2-[1-bromo-6-[[(3-butylbenzofuran-2-carbonyl)-methyl-amino]methyl]-2-naphthoxy]acetic acid Formula: C27H26BrNO5 MolecularWeight: 524.40304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC2=CC=CC=C21)C(=O)N(C)CC3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)Br

Isomeric SMILES

CCCCC1=C(OC2=CC=CC=C21)C(=O)N(C)CC3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)Br

InChI

InChI=1S/C27H26BrNO5/c1-3-4-7-21-20-8-5-6-9-22(20)34-26(21)27(32)29(2)15-17-10-12-19-18(14-17)11-13-23(25(19)28)33-16-24(30)31/h5-6,8-14H,3-4,7,15-16H2,1-2H3,(H,30,31)