2-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)benzoic acid

Systemtic Name: 2-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)benzoic acid Openeye Name: 2-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)benzoic acid CAS Name: 2-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)benzoic acid IUPAC Name: 2-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)benzoic acid Traditional Name: 2-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)benzoic acid Formula: C16H13F3O4 MolecularWeight: 326.26723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=CC(=C2)C(F)(F)F)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=CC(=C2)C(F)(F)F)C(=O)O)OC

InChI

InChI=1S/C16H13F3O4/c1-22-13-6-3-9(7-14(13)23-2)12-8-10(16(17,18)19)4-5-11(12)15(20)21/h3-8H,1-2H3,(H,20,21)