1-[2-(2-bromanyl-6-cyano-phenyl)-1-benzofuran-5-yl]-2-butyl-5-chloranyl-3-methyl-2H-imidazole-4-carboxylic acid

Systemtic Name: 1-[2-(2-bromanyl-6-cyano-phenyl)-1-benzofuran-5-yl]-2-butyl-5-chloranyl-3-methyl-2H-imidazole-4-carboxylic acid Openeye Name: 1-[2-(2-bromo-6-cyano-phenyl)benzofuran-5-yl]-2-butyl-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid CAS Name: 1-[2-(2-bromo-6-cyanophenyl)-5-benzofuranyl]-2-butyl-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid IUPAC Name: 1-[2-(2-bromo-6-cyanophenyl)-1-benzofuran-5-yl]-2-butyl-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid Traditional Name: 1-[2-(2-bromo-6-cyano-phenyl)benzofuran-5-yl]-2-butyl-5-chloro-3-methyl-4-imidazoline-4-carboxylic acid Formula: C24H21BrClN3O3 MolecularWeight: 514.79884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C(=C(N1C2=CC3=C(C=C2)OC(=C3)C4=C(C=CC=C4Br)C#N)Cl)C(=O)O)C

Isomeric SMILES

CCCCC1N(C(=C(N1C2=CC3=C(C=C2)OC(=C3)C4=C(C=CC=C4Br)C#N)Cl)C(=O)O)C

InChI

InChI=1S/C24H21BrClN3O3/c1-3-4-8-20-28(2)22(24(30)31)23(26)29(20)16-9-10-18-15(11-16)12-19(32-18)21-14(13-27)6-5-7-17(21)25/h5-7,9-12,20H,3-4,8H2,1-2H3,(H,30,31)