tert-butyl 5-methyl-2-[[5-methyl-6-[2-(trifluoromethyl)phenyl]pyridin-3-yl]amino]benzoate

Systemtic Name: tert-butyl 5-methyl-2-[[5-methyl-6-[2-(trifluoromethyl)phenyl]pyridin-3-yl]amino]benzoate Openeye Name: tert-butyl 5-methyl-2-[[5-methyl-6-[2-(trifluoromethyl)phenyl]-3-pyridyl]amino]benzoate CAS Name: 5-methyl-2-[[5-methyl-6-[2-(trifluoromethyl)phenyl]-3-pyridinyl]amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-methyl-2-[[5-methyl-6-[2-(trifluoromethyl)phenyl]pyridin-3-yl]amino]benzoate Traditional Name: 5-methyl-2-[[5-methyl-6-[2-(trifluoromethyl)phenyl]-3-pyridyl]amino]benzoic acid tert-butyl ester Formula: C25H25F3N2O2 MolecularWeight: 442.47341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=CN=C(C(=C2)C)C3=CC=CC=C3C(F)(F)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=CN=C(C(=C2)C)C3=CC=CC=C3C(F)(F)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H25F3N2O2/c1-15-10-11-21(19(12-15)23(31)32-24(3,4)5)30-17-13-16(2)22(29-14-17)18-8-6-7-9-20(18)25(26,27)28/h6-14,30H,1-5H3