2-[3-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[3-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[3-[(4-chloro-2,5-dimethoxy-phenyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[3-[(4-chloro-2,5-dimethoxyanilino)-oxomethyl]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[3-[(4-chloro-2,5-dimethoxy-phenyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C29H28ClN3O5 MolecularWeight: 534.00272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC(=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC(=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O)OC)Cl

InChI

InChI=1S/C29H28ClN3O5/c1-37-25-16-23(26(38-2)15-21(25)30)32-28(34)18-8-6-7-17(13-18)27-31-22-14-19(29(35)36)11-12-24(22)33(27)20-9-4-3-5-10-20/h6-8,11-16,20H,3-5,9-10H2,1-2H3,(H,32,34)(H,35,36)