methyl 4-[(2-butyl-6-fluoranyl-benzimidazol-1-yl)methyl]benzoate

Systemtic Name: methyl 4-[(2-butyl-6-fluoranyl-benzimidazol-1-yl)methyl]benzoate Openeye Name: methyl 4-[(2-butyl-6-fluoro-benzimidazol-1-yl)methyl]benzoate CAS Name: 4-[(2-butyl-6-fluoro-1-benzimidazolyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-butyl-6-fluorobenzimidazol-1-yl)methyl]benzoate Traditional Name: 4-[(2-butyl-6-fluoro-benzimidazol-1-yl)methyl]benzoic acid methyl ester Formula: C20H21FN2O2 MolecularWeight: 340.391343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)OC)C=C(C=C2)F

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)OC)C=C(C=C2)F

InChI

InChI=1S/C20H21FN2O2/c1-3-4-5-19-22-17-11-10-16(21)12-18(17)23(19)13-14-6-8-15(9-7-14)20(24)25-2/h6-12H,3-5,13H2,1-2H3