3-[[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-5-chloranyl-2-(3-oxidanylbutyl)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]-5-chloranyl-2-(3-oxidanylbutyl)imidazole-4-carboxylic acid Openeye Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-5-chloro-2-(3-hydroxybutyl)imidazole-4-carboxylic acid CAS Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-5-benzofuranyl]methyl]-5-chloro-2-(3-hydroxybutyl)-4-imidazolecarboxylic acid IUPAC Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl]-5-chloro-2-(3-hydroxybutyl)imidazole-4-carboxylic acid Traditional Name: 3-[[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl]-5-chloro-2-(3-hydroxybutyl)imidazole-4-carboxylic acid Formula: C24H20BrClN6O4 MolecularWeight: 571.8104

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)O)Cl)O

Isomeric SMILES

CC(CCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5)C(=O)O)Cl)O

InChI

InChI=1S/C24H20BrClN6O4/c1-12(33)6-9-18-27-22(26)20(24(34)35)32(18)11-13-7-8-17-16(10-13)19(25)21(36-17)14-4-2-3-5-15(14)23-28-30-31-29-23/h2-5,7-8,10,12,33H,6,9,11H2,1H3,(H,34,35)(H,28,29,30,31)