3-[2-ethyl-1-[4-(2-hydroxyethyl)phenyl]benzimidazol-5-yl]-2-methyl-butanoic acid

Systemtic Name: 3-[2-ethyl-1-[4-(2-hydroxyethyl)phenyl]benzimidazol-5-yl]-2-methyl-butanoic acid Openeye Name: 3-[2-ethyl-1-[4-(2-hydroxyethyl)phenyl]benzimidazol-5-yl]-2-methyl-butanoic acid CAS Name: 3-[2-ethyl-1-[4-(2-hydroxyethyl)phenyl]-5-benzimidazolyl]-2-methylbutanoic acid IUPAC Name: 3-[2-ethyl-1-[4-(2-hydroxyethyl)phenyl]benzimidazol-5-yl]-2-methylbutanoic acid Traditional Name: 3-[2-ethyl-1-[4-(2-hydroxyethyl)phenyl]benzimidazol-5-yl]-2-methyl-butyric acid Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=C(C=C3)CCO)C=CC(=C2)C(C)C(C)C(=O)O

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=C(C=C3)CCO)C=CC(=C2)C(C)C(C)C(=O)O

InChI

InChI=1S/C22H26N2O3/c1-4-21-23-19-13-17(14(2)15(3)22(26)27)7-10-20(19)24(21)18-8-5-16(6-9-18)11-12-25/h5-10,13-15,25H,4,11-12H2,1-3H3,(H,26,27)