1-cyclohexyl-2-[2-fluoranyl-4-(1-phenylethoxy)phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[2-fluoranyl-4-(1-phenylethoxy)phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[2-fluoro-4-(1-phenylethoxy)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[2-fluoro-4-(1-phenylethoxy)phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[2-fluoro-4-(1-phenylethoxy)phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[2-fluoro-4-(1-phenylethoxy)phenyl]benzimidazole-5-carboxylic acid Formula: C28H27FN2O3 MolecularWeight: 458.523983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=CC(=C(C=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O)F

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=CC(=C(C=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O)F

InChI

InChI=1S/C28H27FN2O3/c1-18(19-8-4-2-5-9-19)34-22-13-14-23(24(29)17-22)27-30-25-16-20(28(32)33)12-15-26(25)31(27)21-10-6-3-7-11-21/h2,4-5,8-9,12-18,21H,3,6-7,10-11H2,1H3,(H,32,33)