ethyl 4-[5-fluoranyl-1-[(4-methoxyphenyl)methyl]benzimidazol-2-yl]-3,3-dimethyl-butanoate

Systemtic Name: ethyl 4-[5-fluoranyl-1-[(4-methoxyphenyl)methyl]benzimidazol-2-yl]-3,3-dimethyl-butanoate Openeye Name: ethyl 4-[5-fluoro-1-[(4-methoxyphenyl)methyl]benzimidazol-2-yl]-3,3-dimethyl-butanoate CAS Name: 4-[5-fluoro-1-[(4-methoxyphenyl)methyl]-2-benzimidazolyl]-3,3-dimethylbutanoic acid ethyl ester IUPAC Name: ethyl 4-[5-fluoro-1-[(4-methoxyphenyl)methyl]benzimidazol-2-yl]-3,3-dimethylbutanoate Traditional Name: 4-(5-fluoro-1-p-anisyl-benzimidazol-2-yl)-3,3-dimethyl-butyric acid ethyl ester Formula: C23H27FN2O3 MolecularWeight: 398.470483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)(C)CC1=NC2=C(N1CC3=CC=C(C=C3)OC)C=CC(=C2)F

Isomeric SMILES

CCOC(=O)CC(C)(C)CC1=NC2=C(N1CC3=CC=C(C=C3)OC)C=CC(=C2)F

InChI

InChI=1S/C23H27FN2O3/c1-5-29-22(27)14-23(2,3)13-21-25-19-12-17(24)8-11-20(19)26(21)15-16-6-9-18(28-4)10-7-16/h6-12H,5,13-15H2,1-4H3