3-[[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-2-butyl-5-(trifluoromethyl)imidazole-4-carboxylic acid

Systemtic Name: 3-[[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-2-butyl-5-(trifluoromethyl)imidazole-4-carboxylic acid Openeye Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-2-butyl-5-(trifluoromethyl)imidazole-4-carboxylic acid CAS Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-5-benzofuranyl]methyl]-2-butyl-5-(trifluoromethyl)-4-imidazolecarboxylic acid IUPAC Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-2-butyl-5-(trifluoromethyl)imidazole-4-carboxylic acid Traditional Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-2-butyl-5-(trifluoromethyl)imidazole-4-carboxylic acid Formula: C25H20BrF3N6O3 MolecularWeight: 589.36391

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)O)C(F)(F)F

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)O)C(F)(F)F

InChI

InChI=1S/C25H20BrF3N6O3/c1-2-3-8-18-30-22(25(27,28)29)20(24(36)37)35(18)12-13-9-10-17-16(11-13)19(26)21(38-17)14-6-4-5-7-15(14)23-31-33-34-32-23/h4-7,9-11H,2-3,8,12H2,1H3,(H,36,37)(H,31,32,33,34)