(3-nitrophenyl)methyl 2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanoate

Systemtic Name: (3-nitrophenyl)methyl 2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanoate Openeye Name: (3-nitrophenyl)methyl 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetate CAS Name: 2-[2-(trifluoromethyl)-1-benzimidazolyl]acetic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetic acid (3-nitrobenzyl) ester Formula: C17H12F3N3O4 MolecularWeight: 379.29009

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C17H12F3N3O4/c18-17(19,20)16-21-13-6-1-2-7-14(13)22(16)9-15(24)27-10-11-4-3-5-12(8-11)23(25)26/h1-8H,9-10H2