methyl 4-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]benzoate

Systemtic Name: methyl 4-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]benzoate Openeye Name: methyl 4-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]benzoate CAS Name: 4-[1-butyl-5-(trifluoromethyl)-2-benzimidazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]benzoate Traditional Name: 4-[1-butyl-5-(trifluoromethyl)benzimidazol-2-yl]benzoic acid methyl ester Formula: C20H19F3N2O2 MolecularWeight: 376.37227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C(F)(F)F)N=C1C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C(F)(F)F)N=C1C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H19F3N2O2/c1-3-4-11-25-17-10-9-15(20(21,22)23)12-16(17)24-18(25)13-5-7-14(8-6-13)19(26)27-2/h5-10,12H,3-4,11H2,1-2H3