2-[(2,4-dimethylphenyl)amino]-3,5,6-tris(fluoranyl)-4-methoxy-benzoate

Systemtic Name: 2-[(2,4-dimethylphenyl)amino]-3,5,6-tris(fluoranyl)-4-methoxy-benzoate Openeye Name: 2-(2,4-dimethylanilino)-3,5,6-trifluoro-4-methoxy-benzoate CAS Name: 2-(2,4-dimethylanilino)-3,5,6-trifluoro-4-methoxybenzoate IUPAC Name: 2-(2,4-dimethylanilino)-3,5,6-trifluoro-4-methoxybenzoate Traditional Name: 2-(2,4-dimethylanilino)-3,5,6-trifluoro-4-methoxy-benzoate Formula: C16H13F3NO3- MolecularWeight: 324.27453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C(=C(C(=C2F)OC)F)F)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C(=C(C(=C2F)OC)F)F)C(=O)[O-])C

InChI

InChI=1S/C16H14F3NO3/c1-7-4-5-9(8(2)6-7)20-14-10(16(21)22)11(17)12(18)15(23-3)13(14)19/h4-6,20H,1-3H3,(H,21,22)/p-1