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

Systemtic Name: 1-[[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-5-methyl-imidazole-4-carboxylic acid Openeye Name: 1-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-5-methyl-imidazole-4-carboxylic acid CAS Name: 1-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-5-benzofuranyl]methyl]-5-methyl-4-imidazolecarboxylic acid IUPAC Name: 1-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-5-methylimidazole-4-carboxylic acid Traditional Name: 1-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-5-methyl-imidazole-4-carboxylic acid Formula: C21H15BrN6O3 MolecularWeight: 479.2862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)O

Isomeric SMILES

CC1=C(N=CN1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)O

InChI

InChI=1S/C21H15BrN6O3/c1-11-18(21(29)30)23-10-28(11)9-12-6-7-16-15(8-12)17(22)19(31-16)13-4-2-3-5-14(13)20-24-26-27-25-20/h2-8,10H,9H2,1H3,(H,29,30)(H,24,25,26,27)