ethanedioic acid; 1-[4-[3-(trifluoromethyl)phenoxy]butyl]benzimidazole

Systemtic Name: ethanedioic acid; 1-[4-[3-(trifluoromethyl)phenoxy]butyl]benzimidazole Openeye Name: oxalic acid; 1-[4-[3-(trifluoromethyl)phenoxy]butyl]benzimidazole CAS Name: oxalic acid; 1-[4-[3-(trifluoromethyl)phenoxy]butyl]benzimidazole IUPAC Name: oxalic acid; 1-[4-[3-(trifluoromethyl)phenoxy]butyl]benzimidazole Traditional Name: oxalic acid; 1-[4-[3-(trifluoromethyl)phenoxy]butyl]benzimidazole Formula: C20H19F3N2O5 MolecularWeight: 424.37047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCCCOC3=CC=CC(=C3)C(F)(F)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCCCOC3=CC=CC(=C3)C(F)(F)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H17F3N2O.C2H2O4/c19-18(20,21)14-6-5-7-15(12-14)24-11-4-3-10-23-13-22-16-8-1-2-9-17(16)23;3-1(4)2(5)6/h1-2,5-9,12-13H,3-4,10-11H2;(H,3,4)(H,5,6)