2-[3-bromanyl-5-[(2-butyl-4-chloranyl-5-ethoxycarbonyl-imidazol-1-yl)methyl]-1-benzofuran-2-yl]benzoic acid

Systemtic Name: 2-[3-bromanyl-5-[(2-butyl-4-chloranyl-5-ethoxycarbonyl-imidazol-1-yl)methyl]-1-benzofuran-2-yl]benzoic acid Openeye Name: 2-[3-bromo-5-[(2-butyl-4-chloro-5-ethoxycarbonyl-imidazol-1-yl)methyl]benzofuran-2-yl]benzoic acid CAS Name: 2-[3-bromo-5-[(2-butyl-4-chloro-5-ethoxycarbonyl-1-imidazolyl)methyl]-2-benzofuranyl]benzoic acid IUPAC Name: 2-[3-bromo-5-[(2-butyl-4-chloro-5-ethoxycarbonylimidazol-1-yl)methyl]-1-benzofuran-2-yl]benzoic acid Traditional Name: 2-[3-bromo-5-[(2-butyl-5-carbethoxy-4-chloro-imidazol-1-yl)methyl]benzofuran-2-yl]benzoic acid Formula: C26H24BrClN2O5 MolecularWeight: 559.83616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C(=O)O)C(=O)OCC)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C(=O)O)C(=O)OCC)Cl

InChI

InChI=1S/C26H24BrClN2O5/c1-3-5-10-20-29-24(28)22(26(33)34-4-2)30(20)14-15-11-12-19-18(13-15)21(27)23(35-19)16-8-6-7-9-17(16)25(31)32/h6-9,11-13H,3-5,10,14H2,1-2H3,(H,31,32)