3-[[2-chloranyl-4-(cyclohexyloxymethyl)phenyl]methyl]-2-methyl-benzimidazole-5-carboxylic acid

Systemtic Name: 3-[[2-chloranyl-4-(cyclohexyloxymethyl)phenyl]methyl]-2-methyl-benzimidazole-5-carboxylic acid Openeye Name: 3-[[2-chloro-4-(cyclohexoxymethyl)phenyl]methyl]-2-methyl-benzimidazole-5-carboxylic acid CAS Name: 3-[[2-chloro-4-(cyclohexyloxymethyl)phenyl]methyl]-2-methyl-5-benzimidazolecarboxylic acid IUPAC Name: 3-[[2-chloro-4-(cyclohexyloxymethyl)phenyl]methyl]-2-methylbenzimidazole-5-carboxylic acid Traditional Name: 3-[2-chloro-4-(cyclohexoxymethyl)benzyl]-2-methyl-benzimidazole-5-carboxylic acid Formula: C23H25ClN2O3 MolecularWeight: 412.9092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)COC4CCCCC4)Cl)C=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)COC4CCCCC4)Cl)C=C(C=C2)C(=O)O

InChI

InChI=1S/C23H25ClN2O3/c1-15-25-21-10-9-17(23(27)28)12-22(21)26(15)13-18-8-7-16(11-20(18)24)14-29-19-5-3-2-4-6-19/h7-12,19H,2-6,13-14H2,1H3,(H,27,28)