2-[(2-methylphenyl)methylamino]-5-(trifluoromethyl)benzoic acid

Systemtic Name: 2-[(2-methylphenyl)methylamino]-5-(trifluoromethyl)benzoic acid Openeye Name: 2-(o-tolylmethylamino)-5-(trifluoromethyl)benzoic acid CAS Name: 2-[(2-methylphenyl)methylamino]-5-(trifluoromethyl)benzoic acid IUPAC Name: 2-[(2-methylphenyl)methylamino]-5-(trifluoromethyl)benzoic acid Traditional Name: 2-[(2-methylbenzyl)amino]-5-(trifluoromethyl)benzoic acid Formula: C16H14F3NO2 MolecularWeight: 309.28307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC2=C(C=C(C=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CNC2=C(C=C(C=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C16H14F3NO2/c1-10-4-2-3-5-11(10)9-20-14-7-6-12(16(17,18)19)8-13(14)15(21)22/h2-8,20H,9H2,1H3,(H,21,22)