2-(naphthalen-2-ylamino)-1-[[2-(trifluoromethyl)phenyl]methyl]benzimidazole-5-carboxylic acid

Systemtic Name: 2-(naphthalen-2-ylamino)-1-[[2-(trifluoromethyl)phenyl]methyl]benzimidazole-5-carboxylic acid Openeye Name: 2-(2-naphthylamino)-1-[[2-(trifluoromethyl)phenyl]methyl]benzimidazole-5-carboxylic acid CAS Name: 2-(2-naphthalenylamino)-1-[[2-(trifluoromethyl)phenyl]methyl]-5-benzimidazolecarboxylic acid IUPAC Name: 2-(naphthalen-2-ylamino)-1-[[2-(trifluoromethyl)phenyl]methyl]benzimidazole-5-carboxylic acid Traditional Name: 2-(2-naphthylamino)-1-[2-(trifluoromethyl)benzyl]benzimidazole-5-carboxylic acid Formula: C26H18F3N3O2 MolecularWeight: 461.43523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC3=NC4=C(N3CC5=CC=CC=C5C(F)(F)F)C=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC3=NC4=C(N3CC5=CC=CC=C5C(F)(F)F)C=CC(=C4)C(=O)O

InChI

InChI=1S/C26H18F3N3O2/c27-26(28,29)21-8-4-3-7-19(21)15-32-23-12-10-18(24(33)34)14-22(23)31-25(32)30-20-11-9-16-5-1-2-6-17(16)13-20/h1-14H,15H2,(H,30,31)(H,33,34)