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

Systemtic Name: 1-[3-bromanyl-2-(2-cyanophenyl)-1-benzofuran-4-yl]-2-butyl-5-chloranyl-3-methyl-2H-imidazole-4-carboxylic acid Openeye Name: 1-[3-bromo-2-(2-cyanophenyl)benzofuran-4-yl]-2-butyl-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid CAS Name: 1-[3-bromo-2-(2-cyanophenyl)-4-benzofuranyl]-2-butyl-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid IUPAC Name: 1-[3-bromo-2-(2-cyanophenyl)-1-benzofuran-4-yl]-2-butyl-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid Traditional Name: 1-[3-bromo-2-(2-cyanophenyl)benzofuran-4-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=C3C(=CC=C2)OC(=C3Br)C4=CC=CC=C4C#N)Cl)C(=O)O)C

Isomeric SMILES

CCCCC1N(C(=C(N1C2=C3C(=CC=C2)OC(=C3Br)C4=CC=CC=C4C#N)Cl)C(=O)O)C

InChI

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