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

Systemtic Name: 2-butyl-1-[3-tert-butyl-2-(2-cyanophenyl)-1-benzofuran-5-yl]-5-chloranyl-3-methyl-2H-imidazole-4-carboxylic acid Openeye Name: 2-butyl-1-[3-tert-butyl-2-(2-cyanophenyl)benzofuran-5-yl]-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid CAS Name: 2-butyl-1-[3-tert-butyl-2-(2-cyanophenyl)-5-benzofuranyl]-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid IUPAC Name: 2-butyl-1-[3-tert-butyl-2-(2-cyanophenyl)-1-benzofuran-5-yl]-5-chloro-3-methyl-2H-imidazole-4-carboxylic acid Traditional Name: 2-butyl-1-[3-tert-butyl-2-(2-cyanophenyl)benzofuran-5-yl]-5-chloro-3-methyl-4-imidazoline-4-carboxylic acid Formula: C28H30ClN3O3 MolecularWeight: 492.0091

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C(=C(N1C2=CC3=C(C=C2)OC(=C3C(C)(C)C)C4=CC=CC=C4C#N)Cl)C(=O)O)C

Isomeric SMILES

CCCCC1N(C(=C(N1C2=CC3=C(C=C2)OC(=C3C(C)(C)C)C4=CC=CC=C4C#N)Cl)C(=O)O)C

InChI

InChI=1S/C28H30ClN3O3/c1-6-7-12-22-31(5)24(27(33)34)26(29)32(22)18-13-14-21-20(15-18)23(28(2,3)4)25(35-21)19-11-9-8-10-17(19)16-30/h8-11,13-15,22H,6-7,12H2,1-5H3,(H,33,34)